Introduction：Basic information about CAS 1901-26-4|(3E)-3-Methyl-4-phenyl-3-buten-2-one, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (3E)-3-Methyl-4-phenyl-3-buten-2-one |
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| CAS Number | 1901-26-4 | Molecular Weight | 160.212 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 269.6±9.0 °C at 760 mmHg |
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| Molecular Formula | C11H12O | Melting Point | / |
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| MSDS | / | Flash Point | 96.3±18.0 °C |
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Names
| Name | 3-methyl-4-phenyl-3-buten-2-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
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| Boiling Point | 269.6±9.0 °C at 760 mmHg |
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| Molecular Formula | C11H12O |
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| Molecular Weight | 160.212 |
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| Flash Point | 96.3±18.0 °C |
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| Exact Mass | 160.088821 |
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| PSA | 17.07000 |
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| LogP | 2.72 |
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| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
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| Index of Refraction | 1.553 |
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| InChIKey | BQJFBHBDOAIIGS-HJWRWDBZSA-N |
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| SMILES | CC(=O)C(C)=Cc1ccccc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- EN0214000
- CHEMICAL NAME :
- 3-Buten-2-one, 3-methyl-4-phenyl-
- CAS REGISTRY NUMBER :
- 1901-26-4
- BEILSTEIN REFERENCE NO. :
- 0774487
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C11-H12-O
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4100 mg/kg
- TOXIC EFFECTS :
- Sense Organs and Special Senses (Olfaction) - effect, not otherwise specified Gastrointestinal - changes in structure or function of salivary glands Skin and Appendages - hair
- REFERENCE :
- ATDAEI Acute Toxicity Data. Journal of the American College of Toxicology, Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1- 1990- Volume(issue)/page/year: 1,96,1990
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Safety Information
Customs
| HS Code | 2914399090 |
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| Summary | 2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0% |
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Synonyms
| 3-Methyl-4-phenyl-3-buten-2-on |
| 2-methyl-1-phenylbut-1-en-3-one |
| 4-Phenyl-3-methyl-3-buten-2-one |
| 3-Benzylidene-2-butenone |
| BENZILIDENEMETHYLACETONE |
| 1-METHYL-1-BENZYLIDENE-ACETONE |
| 3-Buten-2-one, 3-methyl-4-phenyl-, (3E)- |
| (3E)-3-Methyl-4-phenyl-3-buten-2-one |
| 3-methyl-4-phenylbut-3-en-2-one |
| (3E)-3-Methyl-4-phenylbut-3-en-2-one |
| 3-BENZYLIDENE-2-BUTANONE |
| 1-Phenyl-2-methyl-1-butene-3-one |
| Benzylidene methyl ethyl ketone |
