benzyl isothiocyanate; benzyl mustard oil; isothiocyanatomethylbenzene; isothiocyanic acid benzyl ester | |
Links: | 📏 NIST, 📖 PubMed |
CAS RN: | [622-78-6] |
Formula: | C8H7NS; 149.22 g/mol |
InChiKey: | MDKCFLQDBWCQCV-UHFFFAOYSA-N |
SMILES: | S=C=NCc1ccccc1 |
Pharmaceutical use: | antitumor; bactericide; fungicide |
Density: | 1.125 g/mL |
Molar volume: | 132.6 mL/mol |
Refractive index: | 1.603 |
Molecular refractive power: | 45.56 mL/mol |
Melting point: | 41 °C |
Boiling point: | 243 °C |
Log10 partition octanol / water: | 3.16 |