Introduction：Basic information about CAS 40235-68-5|1-Acetoxy-3-chloroacetone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1-Acetoxy-3-chloroacetone |
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| CAS Number | 40235-68-5 | Molecular Weight | 150.560 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 200.9±20.0 °C at 760 mmHg |
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| Molecular Formula | C5H7ClO3 | Melting Point | / |
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| MSDS | / | Flash Point | 86.4±20.8 °C |
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Names
| Name | 1-Acetoxy-3-chloroacetone |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 200.9±20.0 °C at 760 mmHg |
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| Molecular Formula | C5H7ClO3 |
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| Molecular Weight | 150.560 |
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| Flash Point | 86.4±20.8 °C |
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| Exact Mass | 150.008377 |
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| PSA | 43.37000 |
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| LogP | 1.16 |
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| Vapour Pressure | 0.3±0.4 mmHg at 25°C |
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| Index of Refraction | 1.431 |
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| InChIKey | LCMPIWIWBGHBOY-UHFFFAOYSA-N |
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| SMILES | CC(=O)OCC(=O)CCl |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- AF8600000
- CHEMICAL NAME :
- Acetic acid, chloroacetylmethyl ester
- CAS REGISTRY NUMBER :
- 40235-68-5
- BEILSTEIN REFERENCE NO. :
- 1759066
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C5-H7-Cl-O3
- MOLECULAR WEIGHT :
- 150.57
- WISWESSER LINE NOTATION :
- G1V1OV1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 71 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 20,644,1977
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Safety Information
| Hazard Codes | T |
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| Risk Phrases | 23/24/25-34 |
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| Safety Phrases | 23-26-36/37/39 |
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| RIDADR | UN 2922 |
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| RTECS | AF8600000 |
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| Packaging Group | II |
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| HS Code | 2915390090 |
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Customs
| HS Code | 2915390090 |
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| Summary | 2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0% |
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Synonyms
| 1-Acetoxy-3-acetenyl Chloride |
| (3-chloro-2-oxopropyl) acetate |
| 3-Chloro-2-oxopropyl acetate |
| 1-Acetoxy-3-chloro-2-propanone |
| 2-Propanone, 1-(acetyloxy)-3-chloro- |
