Introduction：Basic information about CAS 539-88-8|Ethyl 4-oxopentanoate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Ethyl 4-oxopentanoate |
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| CAS Number | 539-88-8 | Molecular Weight | 144.168 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 205.5±0.0 °C at 760 mmHg |
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| Molecular Formula | C7H12O3 | Melting Point | / |
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| MSDS | ChineseUSA | Flash Point | 90.6±0.0 °C |
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Names
| Name | Ethyl Levulinate |
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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 | 205.5±0.0 °C at 760 mmHg |
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| Molecular Formula | C7H12O3 |
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| Molecular Weight | 144.168 |
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| Flash Point | 90.6±0.0 °C |
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| Exact Mass | 144.078644 |
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| PSA | 43.37000 |
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| LogP | 0.40 |
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| Vapour Pressure | 0.2±0.4 mmHg at 25°C |
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| Index of Refraction | 1.416 |
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| InChIKey | GMEONFUTDYJSNV-UHFFFAOYSA-N |
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| SMILES | CCOC(=O)CCC(C)=O |
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| Storage condition | 2-8°C |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- OI1700000
- CHEMICAL NAME :
- Levulinic acid, ethyl ester
- CAS REGISTRY NUMBER :
- 539-88-8
- BEILSTEIN REFERENCE NO. :
- 0507641
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C7-H12-O3
- MOLECULAR WEIGHT :
- 144.19
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,679,1982 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,679,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- >5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,679,1982
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Safety Information
| Personal Protective Equipment | Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US) |
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| Hazard Codes | Xi |
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| Risk Phrases | R36/37/38 |
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| Safety Phrases | S24/25 |
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| RIDADR | NONH for all modes of transport |
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| WGK Germany | 2 |
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| RTECS | OI1700000 |
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| HS Code | 29183000 |
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Customs
| HS Code | 2918300090 |
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| Summary | 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0% |
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Synonyms
| MFCD00009209 |
| Pentanoic acid, 4-oxo-, ethyl ester |
| 4-Ketovaleric Acid Ethyl Ester |
| 4-oxovaleric acid ethyl ester |
| Levulinic Acid Ethyl Ester |
| 3-Acetylpropionic Acid Ethyl Ester |
| Ethyl 4-oxopentanoate |
| EINECS 208-728-2 |
| Ethyl levulinate |
