2-[Amino(3-bromophenyl)methyl]naphthalen-1-ol
Basic information
- CAS
776295-04-6- Standard SMILES
NC(c1cccc(Br)c1)c1ccc2ccccc2c1O- InChIKey
MHCIMYWNWFLLOD-UHFFFAOYSA-N- Molecular formula
- C17H14BrNO
- Average molar mass
- 328.2 g/mol
- Monoisotopic mass
- 327.02588
Names & identifiers
- Preferred name
- 2-[Amino(3-bromophenyl)methyl]naphthalen-1-ol
- IUPAC
- 2-[amino-(3-bromophenyl)methyl]naphthalen-1-ol
- English name
- 2-[AMINO-(3-BROMO-PHENYL)-METHYL]-NAPHTHALEN-1-OL
- Molecular formula
- C17H14BrNO
- Molecular weight
- 328.2
Names & synonyms
776295-04-62-[amino(3-bromophenyl)methyl]-1-naphthol2-[Amino(3-bromophenyl)methyl]naphthalen-1-olDTXSID304778621-Naphthalenol, 2-[amino(3-bromophenyl)methyl]-2-[AMINO-(3-BROMO-PHENYL)-METHYL]-NAPHTHALEN-1-OL
Database identifiers
- CAS
776295-04-6- PubChem CID
- 12118024
- DTXSID
DTXSID30477862- Nikkaji
- J2.278.685G
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 324
Physicochemical properties
- Boiling point
- 499 · 499.0±35.0 °C(Predicted)
- Density
- 1.478 · 1.478±0.06 g/cm3(Predicted)
- pka
- 9.25 · 9.25±0.50(Predicted)
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Related reactions
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Compound notes
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