
2338-76-3
| Name | 3-Trifluoromethylbenzylcyanide |
| CAS | 2338-76-3 |
| EINECS(EC#) | 219-053-8 |
| Molecular Formula | C9H6F3N |
| MDL Number | MFCD00001913 |
| Molecular Weight | 185.15 |
| MOL File | 2338-76-3.mol |
Chemical Properties
| Appearance | CLEAR YELLOW-BROWN LIQUID |
| Boiling point | 92-93 °C4 mm Hg(lit.) |
| density | 1.187 g/mL at 25 °C(lit.) |
| refractive index | n |
| Fp | 120 °F |
| storage temp. | Sealed in dry,Room Temperature |
| form | clear liquid |
| color | Colorless to Almost colorless |
| Specific Gravity | 1.187 |
| BRN | 909640 |
| Exposure limits | NIOSH: IDLH 25 mg/m3 |
| InChI | InChI=1S/C9H6F3N/c10-9(11,12)8-3-1-2-7(6-8)4-5-13/h1-3,6H,4H2 |
| InChIKey | JOIYKSLWXLFGGR-UHFFFAOYSA-N |
| SMILES | C1(CC#N)=CC=CC(C(F)(F)F)=C1 |
| CAS DataBase Reference | 2338-76-3(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzeneacetonitrile, 3-(trifluoromethyl)-(2338-76-3) |
| EPA Substance Registry System | 2338-76-3(EPA Substance) |
Safety Data
| Hazard Codes | Xn,Xi |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 1993 3/PG 3 |
| WGK Germany | 3 |
| RTECS | CY1820000 |
| Hazard Note | Irritant |
| TSCA | T |
| HazardClass | 3 |
| PackingGroup | III |
| HS Code | 29269090 |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Flam. Liq. 3 Skin Irrit. 2 STOT SE 3 |