Introduction：Basic information about CAS 1951-12-8|3-Chlorobutanoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-Chlorobutanoic acid |
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| CAS Number | 1951-12-8 | Molecular Weight | 122.55000 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C4H7ClO2 | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | 3-chlorobutanoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Molecular Formula | C4H7ClO2 |
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| Molecular Weight | 122.55000 |
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| Exact Mass | 122.01300 |
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| PSA | 37.30000 |
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| LogP | 1.08840 |
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| Vapour Pressure | 0.227mmHg at 25°C |
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| InChIKey | XEEMVPPCXNTVNP-UHFFFAOYSA-N |
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| SMILES | CC(Cl)CC(=O)O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- ES8137500
- CHEMICAL NAME :
- Butyric acid, 3-chloro-
- CAS REGISTRY NUMBER :
- 1951-12-8
- BEILSTEIN REFERENCE NO. :
- 1720571
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C4-H7-Cl-O2
- MOLECULAR WEIGHT :
- 122.56
- WISWESSER LINE NOTATION :
- QV1YG1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1180 mg/kg/8W-I
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria Lungs, Thorax, or Respiration - tumors
- REFERENCE :
- CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 39,391,1979
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Safety Information
| Risk Phrases | 34 |
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| Safety Phrases | 26-36/37/39 |
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| RIDADR | UN 3265 |
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| HS Code | 2915900090 |
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Customs
| HS Code | 2915900090 |
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| Summary | 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% 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
| Butanoic acid,3-chloro |
| EINECS 217-771-6 |
| Butyric acid,3-chloro |
| 3-CHLOROBUTYRIC ACID |
