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Basic information
- Standard SMILES
Cc1cc(/C=N/O)ccc1Br- InChIKey
PMXISSFCMNQFSM-BJMVGYQFSA-N- Molecular formula
- C8H8BrNO
- Average molar mass
- 214.06 g/mol
- Monoisotopic mass
- 212.97893
Names & identifiers
- Preferred name
- (NE)-N-[(4-bromo-3-methylphenyl)methylidene]hydroxylamine
- IUPAC
- (NE)-N-[(4-bromo-3-methylphenyl)methylidene]hydroxylamine
Names & synonyms
SCHEMBL111119
Database identifiers
- PubChem CID
- 21833735
Properties
Computed structural propertiesFilling in
- XLogP
- 3.3
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Related reactions
1 records
Compound notes
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