5-Bromobenzofuran-7-amine
Basic information
- CAS
856679-61-3- Standard SMILES
Nc1cc(Br)cc2ccoc12- InChIKey
GQNKOFLMXLJCLQ-UHFFFAOYSA-N- Molecular formula
- C8H6BrNO
- Average molar mass
- 212.04 g/mol
- Monoisotopic mass
- 210.96328
Names & identifiers
- Preferred name
- 5-Bromobenzofuran-7-amine
- IUPAC
- 5-bromo-1-benzofuran-7-amine
- English name
- 5-BROMOBENZOFURAN-7-AMINE
- Molecular formula
- C8H6BrNO
- Molecular weight
- 212.04
Names & synonyms
5-BROMOBENZOFURAN-7-AMINE856679-61-35-BROMO-1-BENZOFURAN-7-AMINESCHEMBL1064292GQNKOFLMXLJCLQ-UHFFFAOYSA-N(5-Bromo-1-benzofuran-7-yl)amineMB10410DA-022057-Benzofuranamine, 5-bromo-
Database identifiers
- CAS
856679-61-3- PubChem CID
- 58771883
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- Boiling point
- 317.6 · 317.6±22.0 °C(Predicted)
- Density
- 1.698 · 1.698±0.06 g/cm3(Predicted)
- pka
- 2.16 · 2.16±0.10(Predicted)
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Related reactions
2 records
Compound notes
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