Introduction：Basic information about CAS 2338-76-3|3-(Trifluoromethyl)benzyl cyanide, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-(Trifluoromethyl)benzyl cyanide |
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| CAS Number | 2338-76-3 | Molecular Weight | 185.146 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 238.9±0.0 °C at 760 mmHg |
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| Molecular Formula | C9H6F3N | Melting Point | / |
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| MSDS | ChineseUSA | Flash Point | 48.9±0.0 °C |
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| Symbol |
GHS02, GHS07 | Signal Word | Warning |
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Names
| Name | 2-[3-(trifluoromethyl)phenyl]acetonitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 238.9±0.0 °C at 760 mmHg |
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| Molecular Formula | C9H6F3N |
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| Molecular Weight | 185.146 |
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| Flash Point | 48.9±0.0 °C |
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| Exact Mass | 185.045227 |
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| PSA | 23.79000 |
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| LogP | 2.02 |
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| Vapour Pressure | 0.0±0.4 mmHg at 25°C |
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| Index of Refraction | 1.458 |
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| InChIKey | JOIYKSLWXLFGGR-UHFFFAOYSA-N |
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| SMILES | N#CCc1cccc(C(F)(F)F)c1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- CY1820000
- CHEMICAL NAME :
- Benzeneacetonitrile, 3-(trifluoromethyl)-
- CAS REGISTRY NUMBER :
- 2338-76-3
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C9-H6-F3-N
- MOLECULAR WEIGHT :
- 185.16
- WISWESSER LINE NOTATION :
- NC1R CXFFF
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 100 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD691-490
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Safety Information
| Symbol |
GHS02, GHS07 |
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| Signal Word | Warning |
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| Hazard Statements | H226-H302 + H312 + H332-H315-H319-H335 |
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| Precautionary Statements | P261-P280-P305 + P351 + P338 |
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| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
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| Hazard Codes | Xn:Harmful; |
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| Risk Phrases | R10;R20/21/22;R36/37/38 |
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| Safety Phrases | S16-S26-S27-S36/37/39 |
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| RIDADR | UN 1993 3/PG 3 |
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| WGK Germany | 3 |
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| RTECS | CY1820000 |
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| Packaging Group | III |
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| Hazard Class | 3 |
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| HS Code | 2926909090 |
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Customs
| HS Code | 2926909090 |
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| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| 3-(Trifluoromethyl)benzyl cyanide |
| MFCD00001913 |
| Acetonitrile, (α,α,α-trifluoro-m-tolyl)- (7CI,8CI) |
| 3-trifluoromethylbenzylcyanide |
| Acetonitrile, (α,α,α-trifluoro-m-tolyl)- |
| EINECS 219-053-8 |
| [3-(Trifluoromethyl)phenyl]acetonitrile |
| Benzeneacetonitrile,3-(trifluoromethyl) |
| NC1R CXFFF |
| Benzeneacetonitrile, 3-(trifluoromethyl)- |
| 3-Trifluoromethylphenylacetonitrile |
| 2-(3-trifluoromethylphenyl)acetonitrile |
| m-Trifluoromethylbenzyl cyanide |
| 2-[3-(Trifluoromethyl)phenyl]acetonitrile |
| 3-(Trifluoromethyl)benzeneacetonitrile |
| 3-(Trifluoromethyl)phenylacetonitrile |
| 2-(m-(trifluoromethyl)phenyl)acetonitrile |
| 3-trifluoromethylbenzylnitrile |
