Molecule ID: 10461

IUPAC Name: 1-chloro-2-(2-chloroethylsulfanyl)ethane

Description: The molecule is an ethyl sulfide that is diethyl sulfide in which a hydrogen from each of the terminal methyl groups is replaced by a chlorine. It is a powerful vesicant regulated under the Chemical Weapons Convention. It has a role as an alkylating agent, a vesicant and a carcinogenic agent. It is an organochlorine compound and an ethyl sulfide.

SMILES: ClCCSCCCl

SELFIES: [Cl][C][C][S][C][C][Cl]

InChI: InChI=1S/C4H8Cl2S/c5-1-3-7-4-2-6/h1-4H2

Molecular Properties:
- Polar Surface Area: 25.3 Ų
- LogP: 2.1