(2R)-2-amino-2-(2-bromo-5-methoxyphenyl)ethan-1-ol
Basic information
- CAS
1213339-89-9- Standard SMILES
COc1ccc(Br)c([C@@H](N)CO)c1- InChIKey
LNVXUCAUPVCQCG-VIFPVBQESA-N- Molecular formula
- C9H12BrNO2
- Average molar mass
- 246.1 g/mol
- Monoisotopic mass
- 245.00514
Names & identifiers
- Preferred name
- (2R)-2-amino-2-(2-bromo-5-methoxyphenyl)ethan-1-ol
- IUPAC
- (2R)-2-amino-2-(2-bromo-5-methoxyphenyl)ethanol
- English name
- (2R)-2-Amino-2-(2-bromo-5-methoxy-phenyl)ethanol
- Molecular formula
- C9H12BrNO2
- Molecular weight
- 246.10108
Names & synonyms
1213339-89-9(2R)-2-amino-2-(2-bromo-5-methoxyphenyl)ethan-1-ol(R)-2-Amino-2-(2-bromo-5-methoxyphenyl)ethan-1-olDTXSID101259043AKOS015929939CS-0302663EN300-1912320(I(2)R)-I(2)-Amino-2-bromo-5-methoxybenzeneethanol(2R)-2-Amino-2-(2-bromo-5-methoxy-phenyl)ethanol
Database identifiers
- CAS
1213339-89-9- PubChem CID
- 66515420
- DTXSID
DTXSID101259043
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 55.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 157
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Compound notes
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