Articles:
| US Patents: | 4,567,291 - 2-Methyl-2-buten-1-yl tiglate |
trans-2-methyl-2-butenyl trans-2-methyl-2-butenoate
Notes:
None found
| Fragrance Demo Formulas Flavor Demo Formulas | ||
| CAS Number: | 72845-40-0 |  3D/inchi
|
| Nikkaji Web: | J447.303E | |
| XlogP3-AA: | 2.80 (est) | |
| Molecular Weight: | 168.23592000 | |
| Formula: | C10 H16 O2 | |
| 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 |
Physical Properties:
| Appearance: | colorless to pale yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 216.00 to 218.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.127000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 191.00 °F. TCC ( 88.40 °C. ) (est) |
| logP (o/w): | 3.003 (est) |
| Soluble in: | |
| alcohol | |
| water, 65.16 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: green | |
| Odor Strength: | medium , recommend smelling in a 10.00 % solution or less |
| forest humus fungal mushroom anise floral leafy | |
| Odor Description: at 10.00 % in dipropylene glycol. | damp forest soil fungus mushroom anise flowery leaf buds |
| 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: | fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for tiglyl tiglate flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| EPA Substance Registry Services (TSCA): | 72845-40-0 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 5281188 |
| National Institute of Allergy and Infectious Diseases: | Data |
| [(E)-2-methylbut-2-enyl] (E)-2-methylbut-2-enoate | |
| Chemidplus: | 0072845400 |
References:
| [(E)-2-methylbut-2-enyl] (E)-2-methylbut-2-enoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 5281188 |
| Pubchem (sid): | 135234406 |
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 |
| KEGG (GenomeNet): | C08546 |
| HMDB (The Human Metabolome Database): | Search |
| ChemSpider: | View |
Potential Blenders and core components note
| For Odor | ||
| floral | ||
| autumn carboxylate | FR | |
| fungal | ||
| 1- | decen-3-ol | FL/FR |
| fungus fragrance | FR | |
| black | truffle whole plant oil | FL/FR |
| herbal | ||
| celery undecene | FR | |
| mushroom | ||
| (R)-1- | octen-3-ol | FL/FR |
| For Flavor | ||
| earthy | ||
| earthy | ||
| 1- | decen-3-ol | FL/FR |
| fungal | ||
| black | truffle whole plant oil | FL/FR |
| mushroom | ||
| (R)-1- | octen-3-ol | FL/FR |
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| trans- | methyl butenyl tiglate |
| (E)-2- | methyl-2-buten-1-yl tiglate |
| (E)-2- | methyl-2-butenyl (E)-2-methyl-2-butenoate |
| trans-2- | methyl-2-butenyl trans-2-methyl-2-butenoate |
| [(E)-2- | methylbut-2-enyl] (E)-2-methylbut-2-enoate |
| (E)- | methylbutenyl tiglate |
| tiglyl tiglate |