Basic information
- Standard SMILES
N[C@@H](CO)CSCc1ccccc1- InChIKey
AUOITUNWAPLMBM-JTQLQIEISA-N- Molecular formula
- C10H15NOS
- Average molar mass
- 197.3 g/mol
Names & identifiers
- Preferred name
- (1S)-1-(Benzylthiomethyl)-2-hydroxyethylamine
- IUPAC
- (2S)-2-amino-3-benzylsulfanylpropan-1-ol
Names & synonyms
Maybridge4_002015Oprea1_301581SCHEMBL7114970AUOITUNWAPLMBM-JTQLQIEISA-NHMS1526L13CCG-56278NCGC00177014-01(1S)-1-(Benzylthiomethyl)-2-hydroxyethylamineSR-01000645247-1BRD-K84332679-001-01-9
Database identifiers
- PubChem CID
- 2817366
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 71.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 126
Related reactions
1 records
Compound notes
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