Category: flavor and fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
Appearance: | colorless to pale yellow clear liquid (est) |
Assay: | 95.00 to 100.00 %
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Food Chemicals Codex Listed: | No |
Boiling Point: | 220.00 to 221.00 °C. @ 760.00 mm Hg
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Vapor Pressure: | 0.020000 mmHg @ 25.00 °C. (est) |
Flash Point: | 185.00 °F. TCC ( 85.00 °C. )
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logP (o/w): | 0.607 (est) |
Soluble in: |
| alcohol | | water, 5.298e+004 mg/L @ 25 °C (est) |
Insoluble in: |
| water | | fat |
Organoleptic Properties:
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Odor Type: fruity |
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| sweet woody ripe fruity pineapple juicy oily |
Odor Description: at 10.00 % in dipropylene glycol. | sweet woody ripe fruity pineapple juicy oily |
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| sweet woody fruit overripe fruit estery pineapple woody tropical |
Odor Description:
| Sweet, woody, overripe, fruity, estry and pineapple-like with woody tropical nuances Mosciano, Gerard P&F 21, No. 4, 51, (1996) |
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Flavor Type: fruity |
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| sweet fruity fruit overripe fruit pineapple tropical woody |
Taste Description: at 5.00 ppm. | Sweet, fruity, overripe, pineapple and tropical with woody nuances Mosciano, Gerard P&F 21, No. 4, 51, (1996) |
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Odor and/or flavor descriptions from others (if found). |
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Kingchem Laboratories |
METHYL 3 HYDROXY HEXANOATE |
Odor Description: | Powerful winey, ethereal, fruity |
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FCI SAS |
METHYL-3-HYDROXY HEXANOATE |
Odor Description: | Powerful winey odor, somewhat juicy |
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Cosmetic Information:
Suppliers:
Safety Information:
Preferred SDS: View |
European information : |
Most important hazard(s): | Xi - Irritant |
R 38 - Irritating to skin. R 41 - Risk of serious damage to eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 37/39 - Wear suitable gloves and eye/face protection.
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Hazards identification |
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Classification of the substance or mixture |
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) |
None found. |
GHS Label elements, including precautionary statements |
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Pictogram | |
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Hazard statement(s) |
None found. |
Precautionary statement(s) |
None found. |
Oral/Parenteral Toxicity: |
Not determined
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Dermal Toxicity: |
Not determined
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Inhalation Toxicity: |
Not determined
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Safety in Use Information:
Category: | flavor and fragrance agents |
RIFM Fragrance Material Safety Assessment: Search |
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice |
Recommendation for pineapple hydroxyhexanoate usage levels up to: | | 4.0000 % in the fragrance concentrate.
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Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.85 (μg/capita/day) |
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). |
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library |
publication number: 10 |
Click here to view publication 10 |
| average usual ppm | average maximum ppm |
baked goods: | - | 5.00000 |
beverages(nonalcoholic): | - | 1.00000 |
beverages(alcoholic): | - | 1.00000 |
breakfast cereal: | - | 5.00000 |
cheese: | - | - |
chewing gum: | - | 1.00000 |
condiments / relishes: | - | - |
confectionery froastings: | - | 1.00000 |
egg products: | - | - |
fats / oils: | - | - |
fish products: | - | - |
frozen dairy: | - | 1.00000 |
fruit ices: | - | 1.00000 |
gelatins / puddings: | - | 1.00000 |
granulated sugar: | - | - |
gravies: | - | - |
hard candy: | - | - |
imitation dairy: | - | - |
instant coffee / tea: | - | - |
jams / jellies: | - | - |
meat products: | - | - |
milk products: | - | 1.00000 |
nut products: | - | - |
other grains: | - | - |
poultry: | - | - |
processed fruits: | - | - |
processed vegetables: | - | - |
reconstituted vegetables: | - | - |
seasonings / flavors: | - | - |
snack foods: | - | - |
soft candy: | - | - |
soups: | - | - |
sugar substitutes: | - | - |
sweet sauces: | - | - |
Safety References:
European Food Safety Athority(EFSA): | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
European Food Safety Authority (EFSA) reference(s): |
Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) on a request from the Commission related to - Flavouring Group Evaluation 10: Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 - (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf |
Flavouring Group Evaluation 10, Revision 1 (FGE10 Rev1)[1] - Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food (AFC) View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 10, Revision 2 (FGE.10Rev2): Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 View page or View pdf |
EPI System: | View |
AIDS Citations: | Search |
Cancer Citations: | Search |
Toxicology Citations: | Search |
EPA Substance Registry Services (TSCA): | 21188-58-9 |
EPA ACToR: | Toxicology Data |
EPA Substance Registry Services (SRS): | Registry |
Laboratory Chemical Safety Summary : | 519845 |
National Institute of Allergy and Infectious Diseases: | Data |
WGK Germany: | 2 |
| methyl 3-hydroxyhexanoate |
Chemidplus: | 0021188589 |
References:
Other Information:
Potential Blenders and core components note
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For Odor |
animal |
animal |
| methyl (E)-2-octenoate | FL/FR |
balsamic |
iso | bornyl propionate | FL/FR |
| fir carboxylate | FR |
| juniper berry oil CO2 extract | FL/FR |
scotch | pine wood/needles resinoid | FR |
| tolu balsam replacer | FR |
berry |
| raspberry ketone methyl ether | FL/FR |
bready |
| furfural | FL/FR |
caramellic |
| maltyl isobutyrate | FL/FR |
chemical |
| propyl propionate | FL/FR |
earthy |
| orris specialty | FR |
fatty |
| allyl octanoate | FL/FR |
| hexyl pivalate | FR |
| methyl 2-hexenoate | FL/FR |
floral |
| anise indene | FR |
| benzaldehyde propylene glycol acetal | FL/FR |
| boronia absolute | FL/FR |
| boronia absolute replacer | FL/FR |
| boronia fragrance | FR |
| bursera graveolens wood oil | FL/FR |
| citronellyl acetate | FL/FR |
2,4- | dimethyl cyclohexyl methyl acetate | FR |
| ionone mixed isomers | FL/FR |
| linalyl propionate | FL/FR |
N- | methyl ionone | FR |
(Z)-beta- | ocimene | FL/FR |
beta- | ocimene | FL/FR |
1-( | octahydro-4,7-methanoinden-5-yl)-propan-2-one + 1-(6-methyloctahydro-4,7-methanoinden-5-yl)-ethanone | |
| orris fragrance | FR |
| orris rhizome absolute (iris germanica) | FL/FR |
| orris rhizome absolute (iris pallida) | FL/FR |
| phenethyl acetate | FL/FR |
fruity |
| allyl 10-undecenoate | FL/FR |
| allyl 3,5,5-trimethyl hexanoate | FL/FR |
| allyl cinnamate | FL/FR |
| allyl cyclohexyl acetate | FL/FR |
| allyl cyclohexyl butyrate | FL/FR |
| allyl cyclohexyl propionate | FL/FR |
| allyl heptanoate | FL/FR |
| allyl hexanoate | FL/FR |
(E,E)- | allyl sorbate | FL/FR |
| allyl sorbate | FL/FR |
| amyl butyrate | FL/FR |
iso | amyl propionate | FL/FR |
| amyl propionate | FL/FR |
| benzyl ethyl ether | FL/FR |
| bisabolene | FL/FR |
| brandy extract | FL/FR |
| buchu wood specialty | FL/FR |
iso | butyl 2-butenoate | FL/FR |
iso | butyl butyrate | FL/FR |
| butyl butyrate | FL/FR |
iso | butyl hexanoate | FL/FR |
iso | butyl isobutyrate | FL/FR |
| butyl isovalerate | FL/FR |
| butyl valerate | FL/FR |
| cinnamyl isobutyrate | FL/FR |
| cyclohexyl hexanoate | FL/FR |
1-(3,3- | dimethyl bicyclo(2.2.1)hept-2-yl)-2-methyl cyclohex-3-ene carbaldehyde | FR |
1,4- | dimethyl bicyclo(3.2.1)oct-3-yl acetate | FR |
1,2- | dimethyl butyl 2-butenoate | FR |
| ethyl (Z)-4-octenoate | FL/FR |
| ethyl 2-octenoate | FL/FR |
| ethyl 3-(2-furyl) propanoate | FL/FR |
| ethyl 3-hexenoate | FL/FR |
| ethyl 3-methyl valerate | FL/FR |
| ethyl cyclohexane propionate | FL/FR |
| ethyl heptanoate | FL/FR |
| ethyl hexanoate | FL/FR |
trans-1- | ethyl-2-methyl propyl 2-butenoate | FL/FR |
1- | ethyl-2-methyl propyl chrysanthemumate | |
1- | ethyl-2-methyl propyl tiglate | |
| geranyl acetoacetate | FL/FR |
| geranyl methyl tiglate | |
| green acetate | FR |
| heptyl isovalerate | FL/FR |
| hexyl isovalerate | FL/FR |
alpha- | ionyl ethyl ether | |
| juicy fruit fragrance | FR |
| kiwi fragrance | FR |
| kiwi specialty | FR |
| methyl (Z)-4-octenoate | FL/FR |
| methyl (Z)-5-octenoate | FL/FR |
2- | methyl butyl acetate | FL/FR |
| methyl hexanoate | FL/FR |
| methyl isovalerate | FL/FR |
| octyl propionate | FL/FR |
| pear fragrance | FR |
| pear specialty | FR |
2- | pentanone | FL/FR |
| perillyl acetate | FL/FR |
| pineapple fragrance | FR |
| pineapple pentenoate | FL/FR |
| propyl heptanoate | FL/FR |
iso | propyl hexanoate | FL/FR |
| propyl hexanoate | FL/FR |
| propyl isobutyrate | FL/FR |
iso | propyl isobutyrate | FL/FR |
iso | propyl isovalerate | FL/FR |
1,3,3,5- | tetramethyl-7 and 8-acetyl bicyclo(2.2.2)oct-5-ene | |
1,3,3,5- | tetramethyl-7 and 8-cyanobicyclo(2.2.2)octane | |
| tropical dienoate (Bedoukian) | FL/FR |
| tropical indene | FR |
| tropical ionone | FL/FR |
| tropical thiazole | FL/FR |
green |
| ethyl (E,Z)-2,4-decadienoate | FL/FR |
| galbanum oxyacetate | FR |
| galbascone (IFF) | FR |
| heptanal dimethyl acetal | FL/FR |
(E)-2- | hexen-1-yl butyrate | FL/FR |
3- | hexenyl 2-methyl butyrate | FL/FR |
1- | penten-3-ol | FL/FR |
| pineapple heptadienone 10% | FR |
herbal |
iso | amyl heptanoate | FL/FR |
| anthemis nobilis flower extract | FL/FR |
| bornyl 2-methyl butyrate | FL/FR |
| bornyl butyrate | FL/FR |
| bursera graveolens wood | |
| herbal specialty | FR |
| herbal undecanone | FR |
| methyl cyclogeranate (Firmenich) | FR |
beta-sesqui | phellandrene | |
| tricyclodecenyl propionate | FR |
| viridiflorol | FL/FR |
spicy |
| clove bud absolute | FL/FR |
| clove bud oil | FL/FR |
| clove bud oil replacer | FR |
| clove fragrance | FR |
N,N- | diethyl octanamide | FR |
| green oxane | FR |
alpha- | methyl cinnamaldehyde | FL/FR |
| pepper tree berry oil CO2 extract | FL/FR |
sulfurous |
| buchu mercaptan | FL/FR |
| cassis pentanone | FL/FR |
| ethyl methyl mercaptopropionate | FL/FR |
| mango thiol | FL/FR |
| passiflora acetate | FL/FR |
tropical |
| tropical 3-thiobutyrate | FL/FR |
waxy |
| orris rhizome oil CO2 extract | FL/FR |
woody |
| juniper berry oleoresin | FL/FR |
| melozol acetate | FR |
| myrtenyl isobutyrate | |
2-N- | propoxy-3(5)-methyl pyrazine | |
| spicy pentanone | FL/FR |
1-(5',5',6'- | trimethyl bicyclo(2.2.1)hept-2'-ylidene) propan-2-one | FR |
yeasty |
2- | octen-4-one | FL/FR |
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For Flavor |
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No flavor group found for these |
| allyl 10-undecenoate | FL/FR |
| allyl 3,5,5-trimethyl hexanoate | FL/FR |
| allyl cinnamate | FL/FR |
| allyl cyclohexyl butyrate | FL/FR |
| allyl sorbate | FL/FR |
(E,E)- | allyl sorbate | FL/FR |
iso | amyl 3-methyl thiopropionate | FL |
| amyl propionate | FL/FR |
| benzyl ethyl ether | FL/FR |
| bornyl 2-methyl butyrate | FL/FR |
| bornyl butyrate | FL/FR |
| boronia absolute replacer | FL/FR |
| buchu wood specialty | FL/FR |
| bursera graveolens wood | |
| bursera graveolens wood oil | FL/FR |
| cyclohexyl hexanoate | FL/FR |
| ethyl 3-methyl valerate | FL/FR |
| ethyl 3-octenoate | FL |
| ethyl cyclohexane propionate | FL/FR |
trans-1- | ethyl-2-methyl propyl 2-butenoate | FL/FR |
1- | ethyl-2-methyl propyl chrysanthemumate | |
1- | ethyl-2-methyl propyl tiglate | |
| heptyl isovalerate | FL/FR |
| ionone mixed isomers | FL/FR |
alpha- | ionyl ethyl ether | |
| methyl (Z)-4-octenoate | FL/FR |
| methyl 2-hexenoate | FL/FR |
| myrtenyl isobutyrate | |
1-( | octahydro-4,7-methanoinden-5-yl)-propan-2-one + 1-(6-methyloctahydro-4,7-methanoinden-5-yl)-ethanone | |
beta-sesqui | phellandrene | |
2-N- | propoxy-3(5)-methyl pyrazine | |
iso | propyl hexanoate | FL/FR |
iso | propyl isobutyrate | FL/FR |
iso | propyl isovalerate | FL/FR |
| sorbyl propionate | FL |
1,3,3,5- | tetramethyl-7 and 8-acetyl bicyclo(2.2.2)oct-5-ene | |
1,3,3,5- | tetramethyl-7 and 8-cyanobicyclo(2.2.2)octane | |
| viridiflorol | FL/FR |
alliaceous |
| tropical thiazole | FL/FR |
balsamic |
iso | bornyl propionate | FL/FR |
| juniper berry oil CO2 extract | FL/FR |
berry |
| raspberry ketone methyl ether | FL/FR |
brown |
| furfural | FL/FR |
citrus |
| bisabolene | FL/FR |
dairy |
| methyl (Z)-5-octenoate | FL/FR |
estery |
| octyl propionate | FL/FR |
fatty |
| allyl octanoate | FL/FR |
floral |
| citronellyl acetate | FL/FR |
| orris flavor | FL |
| tropical ionone | FL/FR |
fruity |
| allyl cyclohexyl acetate | FL/FR |
| allyl cyclohexyl propionate | FL/FR |
| allyl heptanoate | FL/FR |
| allyl hexanoate | FL/FR |
| amyl butyrate | FL/FR |
iso | amyl propionate | FL/FR |
| benzaldehyde propylene glycol acetal | FL/FR |
| boronia absolute | FL/FR |
| brandy extract | FL/FR |
| butyl butyrate | FL/FR |
iso | butyl butyrate | FL/FR |
iso | butyl hexanoate | FL/FR |
iso | butyl isobutyrate | FL/FR |
| butyl isovalerate | FL/FR |
| butyl valerate | FL/FR |
| cinnamyl isobutyrate | FL/FR |
| ethyl (Z)-4-octenoate | FL/FR |
| ethyl 2-octenoate | FL/FR |
| ethyl 3-(2-furyl) propanoate | FL/FR |
| ethyl 3-hexenoate | FL/FR |
| ethyl heptanoate | FL/FR |
| ethyl hexanoate | FL/FR |
| furfuryl valerate | FL |
| geranyl methyl tiglate | |
| methyl (E)-2-octenoate | FL/FR |
2- | methyl butyl acetate | FL/FR |
| methyl hexanoate | FL/FR |
| methyl isovalerate | FL/FR |
2- | pentanone | FL/FR |
| pineapple pentenoate | FL/FR |
| propyl hexanoate | FL/FR |
| propyl isobutyrate | FL/FR |
| spicy pentanone | FL/FR |
| tropical dienoate (Bedoukian) | FL/FR |
green |
iso | butyl 2-butenoate | FL/FR |
| cassis pentanone | FL/FR |
| ethyl (E,Z)-2,4-decadienoate | FL/FR |
| heptanal dimethyl acetal | FL/FR |
(E)-2- | hexen-1-yl butyrate | FL/FR |
3- | hexenyl 2-methyl butyrate | FL/FR |
| hexyl isovalerate | FL/FR |
beta- | ocimene | FL/FR |
(Z)-beta- | ocimene | FL/FR |
1- | penten-3-ol | FL/FR |
| perillyl acetate | FL/FR |
herbal |
iso | amyl heptanoate | FL/FR |
| anthemis nobilis flower extract | FL/FR |
| linalyl propionate | FL/FR |
honey |
| phenethyl acetate | FL/FR |
jammy |
| maltyl isobutyrate | FL/FR |
musty |
| geranyl acetoacetate | FL/FR |
spicy |
| clove bud absolute | FL/FR |
| clove bud oil | FL/FR |
alpha- | methyl cinnamaldehyde | FL/FR |
| pepper tree berry oil CO2 extract | FL/FR |
sulfurous |
| buchu mercaptan | FL/FR |
| ethyl methyl mercaptopropionate | FL/FR |
| mango thiol | FL/FR |
| methyl 2-(methyl thio) butyrate | FL |
| methyl 4-(methyl thio) butyrate | FL |
| methyl thiomethyl butyrate | FL |
| tropical 3-thiobutyrate | FL/FR |
sweet |
| orris rhizome absolute (iris germanica) | FL/FR |
| orris rhizome absolute (iris pallida) | FL/FR |
tropical |
| passiflora acetate | FL/FR |
| pina colada flavor | FL |
| propyl propionate | FL/FR |
vegetable |
2- | octen-4-one | FL/FR |
waxy |
| propyl heptanoate | FL/FR |
woody |
| juniper berry oleoresin | FL/FR |
| orris rhizome oil CO2 extract | FL/FR |
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Potential Uses:
Occurrence (nature, food, other): note
Synonyms:
| hexanoic acid, 3-hydroxy-, methyl ester | 3- | hydroxyhexanoic acid methyl ester | | methyl 3 hydroxy hexanoate | | methyl 3-hydroxy hexanoate | | methyl 3-hydroxycaproate | | methyl 3-hydroxyhexanoate | | methyl b-hydroxycaproate | | methyl b-hydroxyhexanoate | | methyl beta-hydroxycaproate | | methyl beta-hydroxyhexanoate | | methyl-3-hydroxyhexanoate |
Articles:
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