Molecule ID: 3039

IUPAC Name: 2,2-dichloroethenyl dimethyl phosphate

Description: The molecule is an alkenyl phosphate that is the 2,2-dichloroethenyl ester of dimethyl phosphate. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, an anthelminthic drug, an EC 3.1.1.8 (cholinesterase) inhibitor, an antibacterial agent and an antifungal agent. It is an alkenyl phosphate, a dialkyl phosphate, an organophosphate insecticide and an organochlorine acaricide.

SMILES: COP(=O)(OC)OC=C(Cl)Cl

SELFIES: [C][O][P][=Branch1][C][=O][Branch1][Ring1][O][C][O][C][=C][Branch1][C][Cl][Cl]

InChI: InChI=1S/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3

Molecular Properties:
- Polar Surface Area: 44.8 Ų
- LogP: 1.4