tetrahydrojasmone
cyclopentanone, 3-methyl-2-pentyl-
 
Notes:
None found
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CAS Number: 13074-63-0Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 235-969-0
FDA UNII: Search
Nikkaji Web: J317.794G
XlogP3-AA: 3.40 (est)
Molecular Weight: 168.27960000
Formula: C11 H20 O
NMR Predictor: Predict (works with chrome, Edge or firefox)
Category: fragrance agents
 
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 95.00 to 100.00 % sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity: 0.88000 to 0.89000 @  25.00 °C.
Pounds per Gallon - (est).: 7.322 to  7.406
Refractive Index: 1.40000 to 1.50000 @  20.00 °C.
Boiling Point: 85.00 °C. @ 5.00 mm Hg
Boiling Point: 230.00 to  231.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.066000 mmHg @ 25.00 °C. (est)
Flash Point: 200.00 °F. TCC ( 93.33 °C. )
logP (o/w): 3.403 (est)
Soluble in:
 alcohol
 water, 73.11 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: coconut
 
 coconut  sweet  jasmin  spicy  fruity  
Odor Description:
at 100.00 %. 
coconut sweet jasmin spicy fruity
 
Odor and/or flavor descriptions from others (if found).
 
Bedoukian Research
TETRAHYDROJASMONE
Odor Description: Coconut jasmine character
Used in jasmine, coconut, and tropical blends.
 
 
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Cosmetic Information:
None found
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Suppliers:
Ernesto Ventós
TETRAHYDROJASMONE SYNAROME
Odor: FLORAL,JASMIN,CELERY,FRUITY,GREEN
Moellhausen
TETRAHYDRO JASMONE
Penta International
TETRAHYDROJASMONE
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Safety Information:
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and 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 36 - Wear suitable protective clothing.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: 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 tetrahydrojasmone usage levels up to:
  8.0000 % in the fragrance concentrate.
 
Recommendation for tetrahydrojasmone flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 13074-63-0
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 114453
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 2
 3-methyl-2-pentylcyclopentan-1-one
Chemidplus: 0013074630
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References:
 3-methyl-2-pentylcyclopentan-1-one
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 13074-63-0
Pubchem (cid): 114453
Pubchem (sid): 135070782
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
HMDB (The Human Metabolome Database): Search
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
aldehydic
 dodecanal (aldehyde C-12 lauric)FL/FR
amber
 ambroxanFL/FR
 cistus ladaniferus resinoidFL/FR
animal
 animal carbolactoneFR
 costus valerolactoneFR
anisic
para-anisaldehydeFL/FR
 ethyl para-anisateFL/FR
3-pentyl bicyclo[3.2.1]-6-octen-2-oneFR
balsamic
 amyris wood oilFL/FR
siam benzoin resinoidFL/FR
 benzyl cinnamateFL/FR
 benzyl salicylateFL/FR
 butyl cinnamateFL/FR
isobutyl cinnamateFL/FR
 cinnamyl alcoholFL/FR
 clover nitrileFR
 ethyl cinnamateFL/FR
 methyl (E)-cinnamateFL/FR
 phenethyl cinnamateFL/FR
3-phenyl propyl alcoholFL/FR
 tolu balsam oilFL/FR
 tolu balsam oil replacerFR
berry
 raspberry ketoneFL/FR
 raspberry ketone acetateFL/FR
 raspberry ketone methyl etherFL/FR
buttery
 acetoinFL/FR
caramellic
 cycloteneFL/FR
 ethyl maltolFL/FR
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-oneFL/FR
 strawberry furanoneFL/FR
cheesy
2-heptanoneFL/FR
chocolate
isoamyl phenyl acetateFL/FR
citrus
 bergamot oil bergaptene reduced italyFL/FR
coconut
gamma-heptalactoneFL/FR
gamma-nonalactone (aldehyde C-18 (so-called))FL/FR
creamy
 waxy lactoneFL/FR
earthy
 pinus sylvestris leaf absoluteFL/FR
fatty
 decanolFL/FR
floral
alpha-amyl cinnamaldehydeFL/FR
isoamyl salicylateFL/FR
 benzyl acetateFL/FR
 bois de rose oil brazilFL/FR
 cherry blossom fragranceFR
 citronellolFL/FR
 coriander seed oilFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
 dihydrojasmoneFL/FR
 dihydrojasmone lactoneFL/FR
 dimethyl benzyl carbinolFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
isoeugenyl ethyl acetalFR
 floral pyranolFR
pink frangipani absoluteFR
 frangipani specialtyFR
 gardenia taitensis flower absoluteFR
 geraniolFL/FR
 heliotropinFL/FR
 heliotropyl acetoneFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
2-hexylidene cyclopentanoneFL/FR
 hyacinth etherFR
 hydroxycitronellalFL/FR
 jonquil fragranceFR
 leerallFR
 linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
para-methyl acetophenoneFL/FR
 methyl dihydrojasmonateFL/FR
 muguet carboxaldehydeFR
 nerolFL/FR
 nerolidolFL/FR
 ocean propanalFL/FR
2-pentyl cyclopentanoneFR
 phenethyl alcoholFL/FR
 phenethyl phenyl acetateFL/FR
 rhodinolFL/FR
 rhodinyl isobutyrateFL/FR
 rose carboxylateFR
 souroubea specialtyFR
 styralyl isobutyrateFL/FR
 ylang ylang flower oil IIIFL/FR
 jasmin absolute (jasminum flexile)FR
fruity
para-anisyl methyl ketoneFL/FR
 apple cider fragranceFR
baked apple fragranceFR
candy apple fragranceFR
 benzyl propionateFL/FR
gamma-decalactoneFL/FR
1,4-diethyl-6,8-dioxabicyclo(3.2.1)octaneFR
 herbanate (Givaudan)FR
 myrtle oil replacerFR
 strawberry furanone butyrateFL/FR
 strawberry glycidate 1 (aldehyde C-16 (so-called))FL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
 xanthoxylum fruit oilFR
green
 octanal diethyl acetalFL/FR
 thuja occidentalis leaf absoluteFR
herbal
wild carrot seed oil CO2 extractFL/FR
 clary sage oil franceFL/FR
 dimethyl benzyl carbinyl crotonateFL/FR
 lavender absolute bulgariaFL/FR
 myrtle oilFL/FR
 myrtle oil moroccoFL/FR
honey
 methyl phenyl acetateFL/FR
naphthyl
beta-naphthyl ethyl etherFL/FR
powdery
para-anisyl alcoholFL/FR
spicy
alpha-amyl cinnamyl alcoholFL/FR
 apple cinnamon fragranceFR
 bubble gum fragranceFR
 cassia bark oil chinaFL/FR
2,5-dimethyl bicyclo(3.2.1)-2-octen-3-yl acetate + 1,4-dimethyl bicyclo(3.2.1)-2-octen-3-yl acetateFR
isoeugenyl acetateFL/FR
 eugenyl isovalerateFL/FR
alpha-methyl cinnamaldehydeFL/FR
(E)-propyl 2-furan acrylateFL/FR
terpenic
gamma-terpineneFL/FR
alpha-terpineolFL/FR
tonka
 coumarinFR
gamma-hexalactoneFL/FR
vanilla
 ethyl vanillinFL/FR
 vanilla bean absolute (vanilla planifolia)FL/FR
 vanillyl acetateFL/FR
waxy
1-dodecanolFL/FR
woody
 amber carbinolFR
beta-caryophyllene alcohol acetateFL/FR
 guaiacwood oilFL/FR
 kaempferia galanga rhizome oilFL/FR
 methyl cedryl ketoneFL/FR
 patchouli ethanoneFR
 santallFR
 spicy pentanoneFL/FR
 symroxane (Symrise)FR
 vetiver oil fractionsFR
 woody acetateFR
(Z)-woody amyleneFR
 
For Flavor
 
No flavor group found for these
 butyl cinnamateFL/FR
beta-caryophyllene alcohol acetateFL/FR
 cistus ladaniferus resinoidFL/FR
 dimethyl benzyl carbinyl crotonateFL/FR
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-oneFL/FR
 eugenyl isovalerateFL/FR
2-hexylidene cyclopentanoneFL/FR
 methyl (E)-cinnamateFL/FR
 myrtle oil moroccoFL/FR
 pinus sylvestris leaf absoluteFL/FR
 styralyl isobutyrateFL/FR
anise
 ethyl para-anisateFL/FR
balsamic
siam benzoin resinoidFL/FR
 benzyl salicylateFL/FR
isobutyl cinnamateFL/FR
 ethyl cinnamateFL/FR
 phenethyl cinnamateFL/FR
 tolu balsam oilFL/FR
berry
 heliotropyl acetoneFL/FR
 raspberry ketoneFL/FR
 raspberry ketone acetateFL/FR
 raspberry ketone methyl etherFL/FR
camphoreous
 kaempferia galanga rhizome oilFL/FR
caramellic
 cycloteneFL/FR
 ethyl maltolFL/FR
 strawberry furanoneFL/FR
cheesy
2-heptanoneFL/FR
cherry
 heliotropinFL/FR
citrus
 bergamot oil bergaptene reduced italyFL/FR
 linaloolFL/FR
laevo-linaloolFL/FR
 nerolFL/FR
alpha-terpineolFL/FR
coconut
gamma-nonalactone (aldehyde C-18 (so-called))FL/FR
creamy
 acetoinFL/FR
para-anisaldehydeFL/FR
gamma-hexalactoneFL/FR
para-methyl acetophenoneFL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
 waxy lactoneFL/FR
floral
isoamyl phenyl acetateFL/FR
 bois de rose oil brazilFL/FR
 citronellolFL/FR
 dihydrojasmoneFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 geraniolFL/FR
 methyl dihydrojasmonateFL/FR
 methyl phenyl acetateFL/FR
 ocean propanalFL/FR
 phenethyl alcoholFL/FR
 rhodinolFL/FR
 rhodinyl isobutyrateFL/FR
 ylang ylang flower oil IIIFL/FR
fruity
para-anisyl alcoholFL/FR
 benzyl acetateFL/FR
 benzyl propionateFL/FR
gamma-decalactoneFL/FR
(E)-propyl 2-furan acrylateFL/FR
 spicy pentanoneFL/FR
 strawberry furanone butyrateFL/FR
 strawberry glycidate 1 (aldehyde C-16 (so-called))FL/FR
green
isoamyl salicylateFL/FR
 cinnamyl alcoholFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
 linalool oxideFL/FR
 nerolidolFL/FR
 octanal diethyl acetalFL/FR
herbal
wild carrot seed oil CO2 extractFL/FR
 clary sage oil franceFL/FR
 coriander seed oilFL/FR
 lavender absolute bulgariaFL/FR
honey
 phenethyl phenyl acetateFL/FR
lactonic
gamma-heptalactoneFL/FR
medicinal
 dimethyl benzyl carbinolFL/FR
powdery
beta-naphthyl ethyl etherFL/FR
soapy
 dodecanal (aldehyde C-12 lauric)FL/FR
1-dodecanolFL/FR
spicy
alpha-amyl cinnamyl alcoholFL/FR
para-anisyl methyl ketoneFL/FR
 benzyl cinnamateFL/FR
 cassia bark oil chinaFL/FR
isoeugenyl acetateFL/FR
alpha-methyl cinnamaldehydeFL/FR
 myrtle oilFL/FR
3-phenyl propyl alcoholFL/FR
terpenic
gamma-terpineneFL/FR
tropical
alpha-amyl cinnamaldehydeFL/FR
vanilla
 ethyl vanillinFL/FR
 vanilla bean absolute (vanilla planifolia)FL/FR
 vanillyl acetateFL/FR
waxy
 decanolFL/FR
 dihydrojasmone lactoneFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hydroxycitronellalFL/FR
woody
 ambroxanFL/FR
 amyris wood oilFL/FR
 guaiacwood oilFL/FR
 methyl cedryl ketoneFL/FR
 
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Potential Uses:
 apricotFR
 blackberryFR
 butterFR
 butterscotchFR
 caraway seedFL/FR
 chocolate cocoaFL
 christmasFR
 coconutFR
 cookieFL
 creamFR
 fatFL
 fruit tropical fruitFL
 gardeniaFR
 honeyFR
 jasminFR
 mangoFR
 milkFL
 oakwoodFR
 peachFR
 pina coladaFR
 raspberryFR
 root beerFR
 strawberryFR
 tropicalFL
 tuberoseFR
 vanillaFR
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 cyclopentanone, 3-methyl-2-pentyl-
3-methyl-2-pentyl cyclopentan-1-one
3-methyl-2-pentyl cyclopentanone
3-methyl-2-pentylcyclopentan-1-one
3-methyl-2-pentylcyclopentanone
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