Basic information
- Standard SMILES
Cl.NC[C@H]1COc2ccc(O)cc2O1- InChIKey
BCTZYBZYLUKIGF-FJXQXJEOSA-N- Molecular formula
- C9H12ClNO3
- Average molar mass
- 217.65 g/mol
Names & identifiers
- Preferred name
- (S)-7-hydroxy-2,3-dihydro-1,4-benzodioxin-2-methanamine hydrochloride
- IUPAC
- (3S)-3-(aminomethyl)-2,3-dihydro-1,4-benzodioxin-6-ol;hydrochloride
Names & synonyms
SCHEMBL7831882BCTZYBZYLUKIGF-FJXQXJEOSA-N(S)-7-hydroxy-2,3-dihydro-1,4-benzodioxin-2-methanamine hydrochloride
Database identifiers
- PubChem CID
- 70201470
Properties
Computed structural properties
- Topological polar surface area
- 64.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 176
Related reactions
1 records
Compound notes
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