Introduction：Basic information about CAS 31719-77-4|3-(Chloromethyl)benzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-(Chloromethyl)benzoic acid |
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| CAS Number | 31719-77-4 | Molecular Weight | 170.593 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 327.2±25.0 °C at 760 mmHg |
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| Molecular Formula | C8H7ClO2 | Melting Point | 136-138 °C(lit.) |
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| MSDS | ChineseUSA | Flash Point | 151.7±23.2 °C |
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| Symbol |
GHS05, GHS07 | Signal Word | Danger |
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Names
| Name | 3-(Chloromethyl)benzoic 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 | 327.2±25.0 °C at 760 mmHg |
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| Melting Point | 136-138 °C(lit.) |
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| Molecular Formula | C8H7ClO2 |
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| Molecular Weight | 170.593 |
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| Flash Point | 151.7±23.2 °C |
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| Exact Mass | 170.013458 |
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| PSA | 37.30000 |
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| LogP | 2.16 |
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| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
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| Index of Refraction | 1.577 |
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| InChIKey | PBSUMBYSVFTMNG-UHFFFAOYSA-N |
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| SMILES | O=C(O)c1cccc(CCl)c1 |
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| Storage condition | -20°C Freezer, Under Inert Atmosphere |
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| Water Solubility | methanol: 20 mg/mL, clear |
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Safety Information
| Symbol |
GHS05, GHS07 |
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| Signal Word | Danger |
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| Hazard Statements | H302-H312-H314-H332 |
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| Precautionary Statements | P280-P305 + P351 + P338-P310 |
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| Personal Protective Equipment | Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges |
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| Hazard Codes | Xi:Irritant; |
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| Risk Phrases | R36/37/38 |
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| Safety Phrases | S26-S36-S45-S36/37/39 |
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| RIDADR | UN 2811 6.1/PG 3 |
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| WGK Germany | 3 |
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| HS Code | 2916399090 |
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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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Articles1
More Articles
| Molecular structural index control in property-directed clustering and correlation. King JW and Molnar SP. Int. J. Quantum Chem. 80(6) , 1164-1171, (2000)
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Synonyms
| 2-chloromethylbenzoic acid |
| MFCD00191922 |
| 3-(Chloromethyl)benzoic acid |
| 3-Carboxybenzyl chloride |
| Benzoic acid, 3-(chloromethyl)- |
