Molecule ID: 13964946

IUPAC Name: 1-(2,2-dimethylpropyl)-3-(1,2,3-trihydroxypropyl)pyrrole-2-carbaldehyde

Description: The molecule is a pyrrole having neopentyl-, formyl- and 1,2,3-trihydroxypropyl groups at positions 1-, 2- and 3- respectively. It is a member of pyrroles and a triol.

SMILES: CC(C)(C)Cn1ccc(C(O)C(O)CO)c1C=O

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

InChI: InChI=1S/C13H21NO4/c1-13(2,3)8-14-5-4-9(10(14)6-15)12(18)11(17)7-16/h4-6,11-12,16-18H,7-8H2,1-3H3

Molecular Properties:
- Polar Surface Area: 82.7 Ų
- LogP: 0.0