2-(5-Bromo-2-methoxyphenyl)ethanamine
Basic information
- CAS
149488-99-3- Standard SMILES
COc1ccc(Br)cc1CCN- InChIKey
VYKUQILPLBAETB-UHFFFAOYSA-N- Molecular formula
- C9H12BrNO
- Average molar mass
- 230.1 g/mol
- Monoisotopic mass
- 229.01023
Names & identifiers
- Preferred name
- 2-(5-Bromo-2-methoxyphenyl)ethanamine
- IUPAC
- 2-(5-bromo-2-methoxyphenyl)ethanamine
- English name
- 2-(5-bromo-2-methoxyphenyl)ethanamine
- Molecular formula
- C9H12BrNO
- Molecular weight
- 230.10168
Names & synonyms
149488-99-32-(5-bromo-2-methoxyphenyl)ethanamine2-(5-bromo-2-methoxyphenyl)ethan-1-amineCHEMBL542542-(5-Bromo-2-methoxy-phenyl)-ethylamineSCHEMBL129993VYKUQILPLBAETB-UHFFFAOYSA-N5-Bromo-2-methoxybenzeneethanamineDTXSID901297914BDBM50049527AKOS009158505Benzeneethanamine, 5-bromo-2-methoxy-
Show more names
2-(2-methoxy-5-bromophenyl)ethylamine
2-(5-bromo-2-methoxy-phenyl)-ethyl-amineDB-342261EN300-117670
Database identifiers
- CAS
149488-99-3- PubChem CID
- 2735583
- DTXSID
DTXSID901297914- ChEMBL
CHEMBL54254- Nikkaji
- J1.639.446G
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 132
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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