Articles:
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1(3H)-isobenzofuranone, 3a,4-dihydro-3-(2-methylpropylidene)-
Notes:
Odorous constit. of celery
| CAS Number: | 66983-88-8 |  3D/inchi
|
| XlogP3-AA: | 2.80 (est) | |
| Molecular Weight: | 190.24198000 | |
| Formula: | C12 H14 O2 | |
| NMR Predictor: | Predict (works with chrome 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 |
| Soluble in: | |
| water, 367.2 mg/L @ 25 °C (est) | |
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: | natural substances and extractives | ||
| Recommendation for 3a,4-dihydro-3-isobutylidene phthalide usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 3a,4-dihydro-3-isobutylidene phthalide flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 71374939 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 3-(2-methylpropylidene)-3a,4-dihydro-2-benzofuran-1-one |
References:
| 3-(2-methylpropylidene)-3a,4-dihydro-2-benzofuran-1-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 71374939 |
| Pubchem (cas): | 66983-88-8 |
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): | HMDB32027 |
| FooDB: | FDB008726 |
| VCF-Online: | VCF Volatile Compounds in Food |
| EFSA Update of results on the monitoring of furan levels in food: | Read Report |
| EFSA Previous report: Results on the monitoring of furan levels in food: | Read Report |
| EFSA Report of the CONTAM Panel on provisional findings on furan in food: | Read Report |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| celery leaf oil Search Trop Picture | |
| celery seed Search Trop Picture | |
| celery seed oil Search Trop Picture | |
| celery shoot Search Trop Picture | |
| celery stem oil Search Trop Picture |
Synonyms:
| 1(3H)-iso | benzofuranone, 3a,4-dihydro-3-(2-methylpropylidene)- |
| 3a,4- | dihydro-3-isobutylidenephthalide |