Introduction：Basic information about CAS 51-39-8|3,4,5-Trichlorobenzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3,4,5-Trichlorobenzoic acid |
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| CAS Number | 51-39-8 | Molecular Weight | 225.45700 |
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| Density | 1.635g/cm3 | Boiling Point | 345.4ºC at 760mmHg |
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| Molecular Formula | C7H3Cl3O2 | Melting Point | 208-210ºC |
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| MSDS | / | Flash Point | 162.7ºC |
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Names
| Name | 3,4,5-Trichlorobenzoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.635g/cm3 |
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| Boiling Point | 345.4ºC at 760mmHg |
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| Melting Point | 208-210ºC |
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| Molecular Formula | C7H3Cl3O2 |
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| Molecular Weight | 225.45700 |
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| Flash Point | 162.7ºC |
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| Exact Mass | 223.92000 |
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| PSA | 37.30000 |
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| LogP | 3.34500 |
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| Index of Refraction | 1.611 |
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| InChIKey | ICUICNRYLHKQGS-UHFFFAOYSA-N |
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| SMILES | O=C(O)c1cc(Cl)c(Cl)c(Cl)c1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DH8225000
- CHEMICAL NAME :
- Benzoic acid, 3,4,5-trichloro-
- CAS REGISTRY NUMBER :
- 51-39-8
- BEILSTEIN REFERENCE NO. :
- 3267440
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C7-H3-Cl3-O2
- MOLECULAR WEIGHT :
- 225.45
- WISWESSER LINE NOTATION :
- QVR CG DG EG
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 250 mg/kg
- TOXIC EFFECTS :
- Behavioral - altered sleep time (including change in righting reflex) Behavioral - muscle weakness Lungs, Thorax, or Respiration - dyspnea
- REFERENCE :
- BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 13,1538,1964
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Synonyms
| 3,4,5-trichlorobenzoicacid |
| 3,4,5-Trichlor-benzoesaeure |
| BENZOIC ACID,3,4,5-TRICHLORO |
