3-Bromo-4-methylbenzonitrile
ALDRICH/642398 - 97%
CAS Number: 42872-74-2
Empirical Formula (Hill Notation): C8H6BrN
Molecular Weight: 196.04
MDL Number: MFCD06797818
Linear Formula: CH3C6H3(Br)CN
Product Type: Chemical
| assay | 97% |
| form | solid |
| functional group | bromo |
| nitrile | |
| InChI | 1S/C8H6BrN/c1-6-2-3-7(5-1 |
| InChI key | VXUMRYMTYKDWMO-UHFFFAOYSA |
| mp | 41-45 °C (lit.) |
| Quality Level | 100 ![]() |
| SMILES string | Cc1ccc(cc1Br)C#N |
| Packaging: | 25 g in glass bottle |
| Symbol | GHS07 |
| Signal word | Warning |
| Hazard statements | H302 + H312 + H332 |
| Precautionary statements | P280 - P301 + P312 + P330 - P302 + P352 + P312 - P304 + P340 + P312 |
| Hazard Codes | Xn |
| Risk Statements | 20/21/22 |
| Safety Statements | 36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | WGK 3 |
| Flash Point(F) | > 230.0 °F - closed cup |
| Flash Point(C) | > 110 °C - closed cup |
| Purity | 97% |
| mp | 41-45 °C (lit.) |
| UNSPSC | 12352100 |


