Molecule ID: 54564736

IUPAC Name: [4-(2-aminoethyl)phenyl] dihydrogen phosphate

Description: The molecule is an aryl phosphate that is tyramine in which the phenolic hydrogen at position 4 has been replaced by a phospho group. It derives from a tyramine.

SMILES: NCCc1ccc(OP(=O)(O)O)cc1

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

InChI: InChI=1S/C8H12NO4P/c9-6-5-7-1-3-8(4-2-7)13-14(10,11)12/h1-4H,5-6,9H2,(H2,10,11,12)

Molecular Properties:
- Polar Surface Area: 92.8 Ų
- LogP: -2.7