Articles:
| None found yet. Try the PubMed Search. |
C12-14-alkanes
Notes:
Dodecane is a liquid alkane hydrocarbon with the chemical formula CH3(CH2)10CH3. It is an oily liquid of the paraffin series and has 355 isomers. (Wikipedia)
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Lluch Essence S.L. A family company dedicated to sales and distribution Flexibility, availability, price and quality. Flexibility, availability, price and quality make LLUCH ESSENCE S.L. one of Europe’s references when it comes to essential oils and aroma chemicals, and it is now well known all around the world. Email: Info Voice: 34 93 379 38 49 Fax: 34 93 370 65 04 Linkedin Product(s): DODECANE
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| Fragrance Demo Formulas | ||
| CAS Number: | 112-40-3 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 203-967-9 | |
| FDA UNII: | 11A386X1QH | |
| Nikkaji Web: | J1.995J | |
| Beilstein Number: | 1697175 | |
| MDL: | MFCD00008969 | |
| XlogP3: | 6.10 (est) | |
| Molecular Weight: | 170.33922000 | |
| Formula: | C12 H26 | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
| DG SANTE Food Flavourings: | 01.038 dodecane |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Water Content: | <0.003% |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.74600 to 0.75200 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 6.207 to 6.257 |
| Refractive Index: | 1.41700 to 1.42300 @ 20.00 °C. |
| Melting Point: | -12.00 to -9.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 215.00 to 217.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.135000 mmHg @ 25.00 °C. |
| Vapor Density: | 5.96 ( Air = 1 ) |
| Flash Point: | 160.00 °F. TCC ( 71.11 °C. ) |
| logP (o/w): | 6.100 |
| Soluble in: | |
| alcohol | |
| water, 0.1099 mg/L @ 25 °C (est) | |
| water, 0.0037 mg/L @ 25 °C (exp) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Description: | alkane |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| Dodecane |
| EMD Millipore |
| For experimental / research use only. |
| n-Dodecane |
| Lluch Essence |
| DODECANE |
| Sigma-Aldrich |
| For experimental / research use only. |
| Dodecane anhydrous, ≥99% |
| TCI AMERICA |
| For experimental / research use only. |
| Dodecane [Standard Material for GC] >99.5%(GC) |
Safety Information:
| European information : | |
| Most important hazard(s): | |
| Xn - Harmful. | |
|
R 65 - Harmful: may cause lung damage if swallowed. S 02 - Keep out of the reach of children. 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: | |
|
intravenous-mouse LDLo 2672 mg/kg BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) Acta Pharmacologica et Toxicologica. Vol. 37, Pg. 56, 1975. | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
|
inhalation-rat LC50 > 142 ppm/8H Acta Pharmacologica et Toxicologica. Vol. 37, Pg. 56, 1975. inhalation-rat LC50 > 142 ppm/8H Pharmacology and Toxicology Vol. 62, Pg. 259, 1988. | |
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 | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.012 (μg/capita/day) | ||
| Modified Theoretical Added Maximum Daily Intake (mTAMDI): | 3900 (μg/person/day) | ||
| Threshold of Concern: | 1800 (μg/person/day) | ||
| Structure Class: | I | ||
| Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i). | |||
| Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm. | |||
| average usage mg/kg | maximum usage mg/kg | ||
| Dairy products, excluding products of category 02.0 (01.0): | 7.00000 | 35.00000 | |
| Fats and oils, and fat emulsions (type water-in-oil) (02.0): | 5.00000 | 25.00000 | |
| Edible ices, including sherbet and sorbet (03.0): | 10.00000 | 50.00000 | |
| Processed fruit (04.1): | 7.00000 | 35.00000 | |
| Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): | - | - | |
| Confectionery (05.0): | 10.00000 | 50.00000 | |
| Chewing gum (05.0): | - | - | |
| Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): | 5.00000 | 25.00000 | |
| Bakery wares (07.0): | 10.00000 | 50.00000 | |
| Meat and meat products, including poultry and game (08.0): | 2.00000 | 10.00000 | |
| Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): | 2.00000 | 10.00000 | |
| Eggs and egg products (10.0): | - | - | |
| Sweeteners, including honey (11.0): | - | - | |
| Salts, spices, soups, sauces, salads, protein products, etc. (12.0): | 5.00000 | 25.00000 | |
| Foodstuffs intended for particular nutritional uses (13.0): | 10.00000 | 50.00000 | |
| Non-alcoholic ("soft") beverages, excl. dairy products (14.1): | 5.00000 | 25.00000 | |
| Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): | 10.00000 | 50.00000 | |
| Ready-to-eat savouries (15.0): | 20.00000 | 100.00000 | |
| Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): | 5.00000 | 25.00000 | |
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): | |
| Flavouring Group Evaluation 25, (FGE.25)[1] - Aliphatic and aromatic hydrocarbons from chemical group 31 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf | |
| Flavouring Group Evaluation 78 (FGE.78)[1] - Consideration of Aliphatic and alicyclic and aromatic hydrocarbons evaluated by JECFA (63rd meeting) structurally related to aliphatic and aromatic hydrocarbons evaluated by EFSA in FGE.25 - 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 25Rev1: Aliphatic and aromatic hydrocarbons from chemical group 31 View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 78, Revision 1 (FGE.78Rev1): Consideration of aliphatic and alicyclic and aromatic hydrocarbons evaluated by JECFA (63rd meeting) structurally related to aliphatic and aromatic hydrocarbons evaluated by EFSA in FGE.25Rev2 View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 25, Revision 2 (FGE.25Rev2): Aliphatic and aromatic hydrocarbons from chemical group 31 View page or View pdf | |
| Scientific opinion on Flavouring Group Evaluation 25, Revision 3 (FGE.25Rev3): Aliphatic hydrocarbons from chemical group 31 View page or View pdf | |
| Bioaccumulation and toxicity of mineral oil hydrocarbons in rats - specificity of different subclasses of a broad mixture relevant for human dietary exposures View page or View pdf | |
| EPI System: | View |
| Chemical Carcinogenesis Research Information System: | Search |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 112-40-3 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 8182 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 1 |
| dodecane | |
| Chemidplus: | 0000112403 |
| EPA/NOAA CAMEO: | hazardous materials |
| RTECS: | JR2125000 for cas# 112-40-3 |
References:
| dodecane | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 112-40-3 |
| Pubchem (cid): | 8182 |
| Pubchem (sid): | 134973168 |
| Flavornet: | 112-40-3 |
| Pherobase: | View |
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 |
| CHEBI: | View |
| CHEMBL: | View |
| Golm Metabolome Database: | Search |
| KEGG (GenomeNet): | C08374 |
| HMDB (The Human Metabolome Database): | HMDB31444 |
| FooDB: | FDB004726 |
| Export Tariff Code: | 2901.29.1010 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| Wikipedia: | View |
| Formulations/Preparations: •adakane 12 •ba 51-090453 •bihexyl •dihexyl •duodecane | |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| beans - 0.10 mg/kg Search PMC Picture | |
| bergamot oil @ 0.000-0.006% Data GC Search Trop Picture | |
| butter - up to 3.5 mg/kg Search PMC Picture | |
| cabocla flower oil brazil @ 0.30% Data GC Search Trop Picture | |
| carnation absolute @ <0.01% Data GC Search Trop Picture | |
| carrot leaf oil @ 0.48% Data GC Search Trop Picture | |
| cassie absolute @ 0.15% Data GC Search Trop Picture | |
| chicken - 0.02 mg/kg Search PMC Picture | |
| cocoa - 0.10 mg/kg Search Trop Picture | |
| costmary oil @ 0.50% Data GC Search Trop Picture | |
| couroupita guianensis aubl. flower oil brazil @ 0.10% Data GC Search Trop Picture | |
| dialium guineense wild.fruit oil france @ 5.60% Data GC Search Trop Picture | |
| dill - 0.08 mg/kg Search Trop Picture | |
| egg - up to 0.004 mg/kg Search PMC Picture | |
| eschweilera coriacea (a. p. dc.) mori flower oil brazil @ 0.50% Data GC Search Trop Picture | |
| fish raw fish - 0.0006 mg/kg Search PMC Picture | |
| guinea hen - 0.009 mg/kg Search PMC Picture | |
| jambu flower oil brazil @ 0.10% Data GC Search Trop Picture | |
| lamb - up to 0.10 mg/kg Search PMC Picture | |
| lecythis usitata miers. var. paraensis (ducke) r. kunth. flower oil brazil @ 0.20% Data GC Search Trop Picture | |
| licorice - trace amount Search Trop Picture | |
| loquat fruit - up to 0.01 mg/kg Search Trop Picture | |
| orange bigarade oil @ 0.36% Data GC Search Picture | |
| papaya fruit - up to 0.01 mg/kg Search Trop Picture | |
| papaya seed oil Search Trop Picture | |
| passiflora - up to 0.10 mg/kg Search PMC Picture | |
| pea - 0.01 mg/kg Search Trop Picture | |
| strawberry wild strawberry fruit - up to 0.05 mg/kg Search Trop Picture | |
| tea - 0.10 mg/kg Search Trop Picture | |
| tomato Search Trop Picture | |
| ulva rigida oil greece @ 1.30% Data GC Search PMC Picture | |
| walnut black walnut oil Search Trop Picture | |
| witch hazel leaf oil @ 0.03% Data GC Search Trop Picture |
Synonyms:
| adakane 12 | |
| C12-14- | alkanes |
| N- | dodecane |
| norpar 13 | |
| normal | paraffin M |