Introduction：Basic information about CAS 21327-86-6|2-Chloro-6-methylbenzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-Chloro-6-methylbenzoic acid |
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| CAS Number | 21327-86-6 | Molecular Weight | 170.593 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 289.9±20.0 °C at 760 mmHg |
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| Molecular Formula | C8H7ClO2 | Melting Point | 103-105°C |
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| MSDS | ChineseUSA | Flash Point | 129.2±21.8 °C |
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Names
| Name | 2-Chloro-6-methylbenzoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 289.9±20.0 °C at 760 mmHg |
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| Melting Point | 103-105°C |
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| Molecular Formula | C8H7ClO2 |
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| Molecular Weight | 170.593 |
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| Flash Point | 129.2±21.8 °C |
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| Exact Mass | 170.013458 |
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| PSA | 37.30000 |
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| LogP | 2.50 |
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| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
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| Index of Refraction | 1.573 |
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| InChIKey | CEFMMQYDPGCYMG-UHFFFAOYSA-N |
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| SMILES | Cc1cccc(Cl)c1C(=O)O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- XU1645100
- CHEMICAL NAME :
- o-Toluic acid, 6-chloro-
- CAS REGISTRY NUMBER :
- 21327-86-6
- LAST UPDATED :
- 199707
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C8-H7-Cl-O2
- MOLECULAR WEIGHT :
- 170.60
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 422 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
| Hazard Codes | Xi |
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| Risk Phrases | R36/37/38 |
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| Safety Phrases | S26-S36 |
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| RTECS | XU1645100 |
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| HS Code | 2916399090 |
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Preparation
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
| 6-chloro-2-methylbenzoic acid |
| o-methylbenzoic acid |
| 2-Chloro-6-methylbenzoic acid |
| 2-Chlor-6-methyl-benzoesaeure |
| Benzoic acid,6-chloro-4-methyl |
| 6-Chlor-o-toluylsaeure |
| 6-Chloro-o-toluic acid |
| o-Toluic acid,6-chloro |
| Benzoic acid, 2-chloro-6-methyl- |
| 2-Chloro-6-methylbenzoicacid |
| MFCD00045799 |
