Molecule ID: 17040

IUPAC Name: (3,4-dimethylphenyl) N-methylcarbamate

Description: The molecule is a carbamate ester. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, a carbamate insecticide and an agrochemical. It derives from a methylcarbamic acid and a 3,4-xylenol.

SMILES: CN=C(O)Oc1ccc(C)c(C)c1

SELFIES: [C][N][=C][Branch1][C][O][O][C][=C][C][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][Branch2]

InChI: InChI=1S/C10H13NO2/c1-7-4-5-9(6-8(7)2)13-10(12)11-3/h4-6H,1-3H3,(H,11,12)

Molecular Properties:
- Polar Surface Area: 38.3 Ų
- LogP: 2.3