2-Chloro-4-methylphenyl isothiocyanate
2-chloro-1-isothiocyanato-4-methylbenzene
Also Known As: 2-Chloro-4-methylphenyl isothiocyanate|2-Chloro-1-isothiocyanato-4-methylbenzene|2-Chloro-4-methylphenylisothiocyanate|3-Chloro-4-(isothiocyanato)toluene|2-chloro-4-methyl-phenyl isothiocyanate|2-Chloro-4-methylphenyl isothiocyanate,|2-chloro-4-methylbenzenisothiocyanate|2-chloro-4-methylphenyl-isothiocyanate|FS-3878|Benzene, 2-chloro-1-isothiocyanato-4-methyl-|2-chloro-1-isothiocyanato-4-methyl-benzene|2-Chloro-1-isothiocyanato-4-methylbenzene #|Benzene,2-chloro-1-isothiocyanato-4-methyl-|Y-9786|I09-2627|bis(2-chloroethyl) 2-(2-hydroxyethylsulfanyl)ethyl phosphate
| Molecular Formula | C8H6ClNS |
|---|---|
| Molecular Weight | 182.99095 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.99095 |
| Monoisotopic Mass | 182.99095 |
| Heavy Atoms | 11 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 57879-00-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N=C=S)Cl |
| InChIKey | UIZZXGXTVVWRED-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-4-methylphenyl isothiocyanate (CAS 57879-00-2), with molecular formula C8H6ClNS and molecular weight 182.99095 g/mol. IUPAC: 2-chloro-1-isothiocyanato-4-methylbenzene.
2-Chloro-4-methylphenyl isothiocyanate is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »