Articles:
bicyclo[2.2.1]heptane, 2-methyl-3-methylene-2-(4-methyl-3-pentenyl)-, (1S-endo)-
Notes:
Constit. from oil of the famine food Santalum album (sandalwood). Flavouring ingredient
| CAS Number: | 511-59-1 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 208-130-1 | |
| XlogP3-AA: | 5.30 (est) | |
| Molecular Weight: | 204.35628000 | |
| Formula: | C15 H24 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: flavor and 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 |
Physical Properties:
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 259.00 to 260.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.020000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 213.00 °F. TCC ( 100.56 °C. ) |
| logP (o/w): | 6.145 (est) |
| Soluble in: | |
| alcohol | |
| water, 0.02557 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Description: | woody |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Suppliers:
| None found |
Safety Information:
| 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 | |
Safety in Use Information:
| Category: | flavor and fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 511-59-1 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 10534 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 6-methyl-5-methylidene-6-(4-methylpent-3-enyl)bicyclo[2.2.1]heptane | |
| Chemidplus: | 0000511591 |
References:
| Leffingwell: | Chirality or Article |
| 6-methyl-5-methylidene-6-(4-methylpent-3-enyl)bicyclo[2.2.1]heptane | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 511-59-1 |
| Pubchem (cid): | 10534 |
| Pubchem (sid): | 134977977 |
| 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 |
| KEGG (GenomeNet): | C09718 |
| HMDB (The Human Metabolome Database): | Search |
| FooDB: | FDB015240 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
Potential Blenders and core components note
Potential Uses:
Occurrence (nature, food, other): note
| basil oil Search Trop Picture | |
| carrot seed oil @ 0.67% Data GC Search Trop Picture | |
| galangal root oil @ 0.48% Data GC Search Trop Picture | |
| lavandin oil abrialis @ trace% Data GC Search Trop Picture | |
| lemon oil california @ 0.01% Data GC Search Trop Picture | |
| lime oil distilled mexico @ 0.04% Data GC Search Trop Picture | |
| lime oil distilled peru @ 0.04% Data GC Search Trop Picture | |
| lime oil expressed florida @ trace% Data GC Search Trop Picture | |
| sandalwood oil east indian @ 1.40% Data GC Search Trop Picture | |
| sugandha kokila berry oil @ 0.80% Data GC Search Trop Picture | |
| witch hazel leaf oil @ 0.03% Data GC Search Trop Picture |
Synonyms:
| bicyclo[2.2.1]heptane, 2-methyl-3-methylene-2-(4-methyl-3-pentenyl)-, (1S-endo)- | |
| (1S-exo)-2- | methyl-3-methylene-2-(4-methyl-3-pentenyl) bicyclo(2.2.1)heptane |
| (1S,2R,4R)-2- | methyl-3-methylene-2-(4-methyl-3-pentenyl) bicyclo(2.2.1)heptane |
| (1S-exo)-2- | methyl-3-methylene-2-(4-methyl-3-pentenyl)bicyclo(2.2.1)heptane |
| 6- | methyl-5-methylidene-6-(4-methylpent-3-enyl)bicyclo[2.2.1]heptane |
| beta- | santala-3(15),10-diene |
| (-)-beta- | santalene |