Introduction：Basic information about CAS 1012-84-6|Pentachlorobenzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Pentachlorobenzoic acid |
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| CAS Number | 1012-84-6 | Molecular Weight | 294.34700 |
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| Density | 1.82g/cm3 | Boiling Point | 379.1ºC at 760mmHg |
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| Molecular Formula | C7HCl5O2 | Melting Point | / |
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| MSDS | / | Flash Point | 183ºC |
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Names
| Name | 2,3,4,5,6-pentachlorobenzoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.82g/cm3 |
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| Boiling Point | 379.1ºC at 760mmHg |
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| Molecular Formula | C7HCl5O2 |
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| Molecular Weight | 294.34700 |
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| Flash Point | 183ºC |
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| Exact Mass | 291.84200 |
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| PSA | 37.30000 |
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| LogP | 4.65180 |
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| Vapour Pressure | 2.02E-06mmHg at 25°C |
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| Index of Refraction | 1.631 |
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| InChIKey | IONYGGJUUJFXJK-UHFFFAOYSA-N |
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| SMILES | O=C(O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DH6190000
- CHEMICAL NAME :
- Benzoic acid, pentachloro-
- CAS REGISTRY NUMBER :
- 1012-84-6
- BEILSTEIN REFERENCE NO. :
- 0986504
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C7-H-Cl5-O2
- MOLECULAR WEIGHT :
- 294.33
- WISWESSER LINE NOTATION :
- QVR BG CG DG EG FG
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 178 mg/kg
- TOXIC EFFECTS :
- Behavioral - rigidity (including catalepsy) Behavioral - muscle contraction or spasticity
- 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: 11,1020,1968
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Safety Information
Customs
| HS Code | 2916399090 |
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| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| BENZOIC ACID,PENTACHLORO |
| Perchlorbenzoesaeure |
| pentachlorobenzoic acid |
| Perchlorobenzoic acid |
| Pentachlor-benzoesaeure |
