Molecule ID: 876160

IUPAC Name: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] acetate

Description: The molecule is a phenylpropanoid that is the acetate ester of trans-isoeugenol. It is a phenylpropanoid, a monomethoxybenzene and a member of phenyl acetates. It derives from a trans-isoeugenol.

SMILES: C/C=C/c1ccc(OC(C)=O)c(OC)c1

SELFIES: [C][/C][=C][/C][=C][C][=C][Branch1][#Branch1][O][C][Branch1][C][C][=O][C][Branch1][Ring1][O][C][=C][Ring1][N]

InChI: InChI=1S/C12H14O3/c1-4-5-10-6-7-11(15-9(2)13)12(8-10)14-3/h4-8H,1-3H3/b5-4+

Molecular Properties:
- Polar Surface Area: 35.5 Ų
- LogP: 2.4