Articles:
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3-oxo-butanoic acid (4-methoxyphenyl)methyl ester
Notes:
None found
| CAS Number: | 61312-35-4 |  3D/inchi
|
| Nikkaji Web: | J429.423H | |
| XlogP3-AA: | 1.40 (est) | |
| Molecular Weight: | 222.24038000 | |
| Formula: | C12 H14 O4 | |
| 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: | 324.00 to 326.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.000220 mmHg @ 25.00 °C. (est) |
| Flash Point: | 287.00 °F. TCC ( 141.67 °C. ) |
| logP (o/w): | 1.488 (est) |
| Soluble in: | |
| alcohol | |
| water, 3894 mg/L @ 25 °C (est) | |
| Similar Items: note | |
| amyl acetoacetate | |
| isoamyl acetoacetate | |
| benzyl acetoacetate | |
| bergamot acetoacetate | |
| butyl acetoacetate | |
| isobutyl acetoacetate | |
| cinnamyl acetoacetate | |
| cyclohexyl acetoacetate | |
| dodecyl acetoacetate | |
| ethyl 2-ethyl acetoacetate | |
| ethyl acetoacetate | |
| geranyl acetoacetate | |
| heptyl acetoacetate | |
| (Z)-3-hexen-1-yl acetoacetate | |
| hexyl acetoacetate | |
| jasmin acetoacetate | |
| laevo-menthyl acetoacetate | |
| methyl acetoacetate | |
| spicy acetoacetate | |
Organoleptic Properties:
| 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: | 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): | 61312-35-4 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 109074 |
| National Institute of Allergy and Infectious Diseases: | Data |
| (4-methoxyphenyl)methyl 3-oxobutanoate | |
| Chemidplus: | 0061312354 |
References:
| (4-methoxyphenyl)methyl 3-oxobutanoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 109074 |
| Pubchem (sid): | 135065305 |
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 |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| p- | anisyl acetoacetate |
| 3-oxo- | butanoic acid (4-methoxyphenyl)methyl ester |
| butanoic acid, 3-oxo-, (4-methoxyphenyl)methyl ester | |
| butanoic acid, 3-oxo-,(4-methoxyphenyl)methyl ester | |
| (4- | methoxyphenyl)methyl 3-oxobutanoate |