(S)-4-aminobutane-1,2-diol
Basic information
- Standard SMILES
NCC[C@H](O)CO- InChIKey
ARZSRJNMSIMAKS-BYPYZUCNSA-N- Molecular formula
- C4H11NO2
- Average molar mass
- 105.14 g/mol
- Monoisotopic mass
- 105.07897859
Names & identifiers
- Preferred name
- (S)-4-aminobutane-1,2-diol
- IUPAC
- (2S)-4-aminobutane-1,2-diol
Names & synonyms
(S)-4-aminobutane-1,2-diol(2S)-4-aminobutane-1,2-diol82267-25-2SCHEMBL736633(S)-4-amino-butane-1,2-diolARZSRJNMSIMAKS-BYPYZUCNSA-NAKOS006338329CS-0529794EN300-781106
Database identifiers
- PubChem CID
- 55281176
Properties
Computed structural properties
- XLogP
- -1.7
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 40.7
Related reactions
5 records
Compound notes
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