Molecule ID: 21680226

IUPAC Name: [2-hydroxy-2-(4-hydroxyphenyl)ethyl]azanium

Description: The molecule is the conjugate acid of octopamine; major species at pH 7.3. It is an ammonium ion derivative and an organic cation. It is a conjugate acid of an octopamine.

SMILES: [NH3+]CC(O)c1ccc(O)cc1

SELFIES: [NH3+1][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]

InChI: InChI=1S/C8H11NO2/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4,8,10-11H,5,9H2/p+1

Molecular Properties:
- Polar Surface Area: 68.1 Ų
- LogP: -1.1