Molecule ID: 1030

IUPAC Name: propane-1,2-diol

Description: The molecule is the simplest member of the class of propane-1,2-diols, consisting of propane in which a hydrogen at position 1 and a hydrogen at position 2 are substituted by hydroxy groups. A colourless, viscous, hygroscopic, low-melting (-59鈩? and high-boiling (188鈩? liquid with low toxicity, it is used as a solvent, emulsifying agent, and antifreeze. It has a role as a protic solvent, an allergen, a human xenobiotic metabolite and a mouse metabolite. It is a member of propane-1,2-diols and a glycol.

SMILES: CC(O)CO

SELFIES: [C][C][Branch1][C][O][C][O]

InChI: InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3

Molecular Properties:
- Polar Surface Area: 40.5 Ų
- LogP: -0.9