4-[(1S)-2-amino-1-hydroxyethyl]-5-chlorobenzene-1,2-diol
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Basic information
- CAS
768345-73-9- Standard SMILES
NC[C@@H](O)c1cc(O)c(O)cc1Cl- InChIKey
BFLJQMNDLRDYQK-MRVPVSSYSA-N- Molecular formula
- C8H10ClNO3
- Average molar mass
- 203.62 g/mol
- Monoisotopic mass
- 203.0349209
Names & identifiers
- Preferred name
- 4-[(1S)-2-amino-1-hydroxyethyl]-5-chlorobenzene-1,2-diol
- IUPAC
- 4-[(1S)-2-amino-1-hydroxyethyl]-5-chlorobenzene-1,2-diol
- English name
- 1,2-Benzenediol, 4-[(1S)-2-amino-1-hydroxyethyl]-5-chloro- (9CI)
- Molecular formula
- C8H10ClNO3
- Molecular weight
- 203.62
Names & synonyms
768345-73-9DB-2673181,2-BENZENEDIOL, 4-[(1S)-2-AMINO-1-HYDROXYETHYL]-5-CHLORO-4-[(1S)-2-amino-1-hydroxyethyl]-5-chlorobenzene-1,2-diol1,2-Benzenediol, 4-[(1S)-2-amino-1-hydroxyethyl]-5-chloro- (9CI)
Database identifiers
- CAS
768345-73-9- PubChem CID
- 45092939
- Nikkaji
- J1.070.882F
Properties
Computed structural propertiesFilling in
- XLogP
- 0
- Topological polar surface area
- 86.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 169
Related reactions
0 records
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Compound notes
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