Articles:
2,6-octadienoic acid, 3,7-dimethyl-, methyl ester, (2Z)-
Notes:
None found
| CAS Number: | 1862-61-9 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 217-466-8 | |
| FDA UNII: | VBZ4J48WZZ | |
| Nikkaji Web: | J113.555D | |
| XlogP3-AA: | 3.40 (est) | |
| Molecular Weight: | 182.26286000 | |
| Formula: | C11 H18 O2 | |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) | |
Category: natural substances and extractives
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 |
| 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: | 247.43 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.026000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 229.00 °F. TCC ( 109.60 °C. ) (est) |
| logP (o/w): | 3.972 (est) |
| Soluble in: | |
| alcohol | |
| water, 21.24 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: floral | |
| floral herbal citrus fruity green geranium | |
| Odor Description: at 100.00 %. | floral herbal citrus fruity green geranium |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
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: | natural substances and extractives | ||
| Recommendation for methyl nerate usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for methyl nerate flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 1862-61-9 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 5365912 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| methyl (2Z)-3,7-dimethylocta-2,6-dienoate | |
| Chemidplus: | 0001862619 |
References:
| methyl (2Z)-3,7-dimethylocta-2,6-dienoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 5365912 |
| Pubchem (sid): | 135037088 |
| 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 |
| HMDB (The Human Metabolome Database): | Search |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| citrus | FR | |
| fruit | FR | |
| geranium | FR | |
| green | FR | |
| herbal | FR |
Occurrence (nature, food, other): note
| magnolia salicifolia Search Trop Picture | |
| magnolia southern magnolia Search Trop Picture | |
| rosa centifolia Search Trop Picture | |
| rosa damascena Search Trop Picture |
Synonyms:
| methyl (2Z)-3,7-dimethylocta-2,6-dienoate | |
| methyl (Z)-3,7-dimethyl octa-2,6-dienoate | |
| methyl (Z)-3,7-dimethylocta-2,6-dienoate | |
| methyl (Z)-geranate | |
| (Z)- | methyl dimethyl octadienoate |
| (Z)- | methyl geranate |
| methyl-(Z)-geranate | |
| cis-2,6- | octadienoic acid, 3,7-dimethyl-, methyl ester |
| 2,6- | octadienoic acid, 3,7-dimethyl-, methyl ester, (2Z)- |
| 2,6- | octadienoic acid, 3,7-dimethyl-, methyl ester, (Z)- |