Introduction:Basic information about CAS 140-53-4|4-Chlorobenzyl cyanide, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-Chlorobenzyl cyanide |
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| CAS Number | 140-53-4 | Molecular Weight | 151.59 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 266.0±0.0 °C at 760 mmHg |
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| Molecular Formula | C8H6ClN | Melting Point | 25-28 °C(lit.) |
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| MSDS | ChineseUSA | Flash Point | 107.7±15.4 °C |
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| Symbol | GHS06 | Signal Word | Danger |
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Names
| Name | 4-chlorophenylacetonitrile |
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| Synonym | More Synonyms |
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4-Chlorobenzyl cyanide BiologicalActivity
| Description | 4-Chlorobenzyl cyanide is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
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| Related Catalog | Research Areas >>OthersSignaling Pathways >>Others >>Others |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 266.0±0.0 °C at 760 mmHg |
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| Melting Point | 25-28 °C(lit.) |
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| Molecular Formula | C8H6ClN |
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| Molecular Weight | 151.59 |
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| Flash Point | 107.7±15.4 °C |
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| Exact Mass | 151.018875 |
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| PSA | 23.79000 |
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| LogP | 2.04 |
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| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
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| Index of Refraction | 1.549 |
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| InChIKey | IVYMIRMKXZAHRV-UHFFFAOYSA-N |
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| SMILES | N#CCc1ccc(Cl)cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- AL8250000
- CHEMICAL NAME :
- Acetonitrile, (p-chlorophenyl)-
- CAS REGISTRY NUMBER :
- 140-53-4
- BEILSTEIN REFERENCE NO. :
- 0971171
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 7
- MOLECULAR FORMULA :
- C8-H6-Cl-N
- MOLECULAR WEIGHT :
- 151.60
- WISWESSER LINE NOTATION :
- NC1R DG
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 150 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 14,1325,1965
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 27 mg/kg
- TOXIC EFFECTS :
- Peripheral Nerve and Sensation - spastic paralysis with or without sensory change Behavioral - convulsions or effect on seizure threshold
- REFERENCE :
- PCBPBS Pesticide Biochemistry and Physiology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1971- Volume(issue)/page/year: 2,95,1972
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 56 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#07883 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X4034 No. of Facilities: 17 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 851 (estimated) No. of Female Employees: 187 (estimated)
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Safety Information
| Symbol | GHS06 |
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| Signal Word | Danger |
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| Hazard Statements | H301-H311-H315-H319-H331-H335 |
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| Precautionary Statements | P261-P280-P301 + P310-P305 + P351 + P338-P311 |
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| Personal Protective Equipment | Eyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges |
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| Hazard Codes | T:Toxic |
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| Risk Phrases | R23/24/25;R36/37/38 |
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| Safety Phrases | S26-S36/37/39-S45-S28B |
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| RIDADR | UN 2811 6.1/PG 3 |
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| WGK Germany | 3 |
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| RTECS | AL8250000 |
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| Packaging Group | II |
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| Hazard Class | 6.1 |
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| HS Code | 29269095 |
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Customs
| HS Code | 2926901000 |
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| Summary | HS: 2926901000. 2-(4-chlorophenyl)acetonitrile. VAT:17.0%. tax rebate rate:9.0%. supervision conditions:None. MFN tarrif:4.0%. general tariff:11.0% |
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Synonyms
| 4-Chlorobenzyl Cyanide |
| Benzeneacetonitrile, 4-chloro- |
| (4-Chlorophenyl)acetonitrile |
| 4-chlorophenylacetonitrile |
| EINECS 205-418-9 |
| 2-(4-chlorophenyl)acetonitrile |
| MFCD00001918 |
| p-Chlorobenzyl cyanide |