1-(bromomethyl)-4-isothiocyanatobenzene
Chemical Structure Depiction of
1-(bromomethyl)-4-isothiocyanatobenzene
1-(bromomethyl)-4-isothiocyanatobenzene
Compound characteristics
| Compound ID: | 8019-6452 |
| Compound Name: | 1-(bromomethyl)-4-isothiocyanatobenzene |
| Molecular Weight: | 228.11 |
| Molecular Formula: | C8 H6 Br N S |
| Smiles: | C(c1ccc(cc1)N=C=S)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.8568 |
| logD: | 3.8568 |
| logSw: | -4.1799 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 8.9486 |
| InChI Key: | NSQGUALFBVTBHL-UHFFFAOYSA-N |