Introduction：Basic information about CAS 16062-88-7|n-Butyl fumarate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | n-Butyl fumarate |
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| CAS Number | 16062-88-7 | Molecular Weight | 172.17800 |
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| Density | 1.13g/cm3 | Boiling Point | 289.1ºC at 760mmHg |
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| Molecular Formula | C8H12O4 | Melting Point | / |
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| MSDS | / | Flash Point | 113.9ºC |
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Names
| Name | (E)-4-butoxy-4-oxobut-2-enoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.13g/cm3 |
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| Boiling Point | 289.1ºC at 760mmHg |
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| Molecular Formula | C8H12O4 |
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| Molecular Weight | 172.17800 |
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| Flash Point | 113.9ºC |
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| Exact Mass | 172.07400 |
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| PSA | 63.60000 |
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| LogP | 0.97050 |
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| Vapour Pressure | 0.000565mmHg at 25°C |
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| Index of Refraction | 1.47 |
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| InChIKey | UTOVMEACOLCUCK-SNAWJCMRSA-N |
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| SMILES | CCCCOC(=O)C=CC(=O)O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- LT2150000
- CHEMICAL NAME :
- Fumaric acid, monobutyl ester
- CAS REGISTRY NUMBER :
- 16062-88-7
- LAST UPDATED :
- 199206
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C8-H12-O4
- MOLECULAR WEIGHT :
- 172.20
- WISWESSER LINE NOTATION :
- QV1U1VO4 -T
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intramuscular
- SPECIES OBSERVED :
- Rodent - guinea pig
- DOSE/DURATION :
- 3 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 76,189,1942
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Safety Information
Customs
| HS Code | 2918990090 |
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| Summary | 2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
