Molecule ID: 62773

IUPAC Name: (7-chloro-6-bicyclo[3.2.0]hepta-2,6-dienyl) dimethyl phosphate

Description: The molecule is a trialkyl phosphate, an organophosphate insecticide and an organochlorine compound. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, an acaricide and an agrochemical. It derives from a hydride of a bicyclo[3.2.0]hepta-2,6-diene.

SMILES: COP(=O)(OC)OC1=C(Cl)C2C=CCC12

SELFIES: [C][O][P][=Branch1][C][=O][Branch1][Ring1][O][C][O][C][=C][Branch1][C][Cl][C][C][=C][C][C][Ring1][Branch2][Ring1][Branch1]

InChI: InChI=1S/C9H12ClO4P/c1-12-15(11,13-2)14-9-7-5-3-4-6(7)8(9)10/h3-4,6-7H,5H2,1-2H3

Molecular Properties:
- Polar Surface Area: 44.8 Ų
- LogP: 1.3