Molecule ID: 82494

IUPAC Name: naphthalen-2-yl octanoate

Description: The molecule is a octanoate ester obtained by formal condensation of the carboxy group of octanoic acid with the hydroxy group of 2-naphthol. It has a role as a chromogenic compound. It is an octanoate ester, an aromatic ester and a member of naphthalenes. It derives from a 2-naphthol.

SMILES: CCCCCCCC(=O)Oc1ccc2ccccc2c1

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

InChI: InChI=1S/C18H22O2/c1-2-3-4-5-6-11-18(19)20-17-13-12-15-9-7-8-10-16(15)14-17/h7-10,12-14H,2-6,11H2,1H3

Molecular Properties:
- Polar Surface Area: 26.3 Ų
- LogP: 5.7