Basic information
- CAS
1082703-37-4- Standard SMILES
O=[N+]([O-])/C=C\c1ccc(O)cc1- InChIKey
CTJKRKMPTRJAIT-WAYWQWQTSA-N- Molecular formula
- C8H7NO3
- Average molar mass
- 165.15 g/mol
- Monoisotopic mass
- 165.04259309
Names & identifiers
- Preferred name
- (Z)-4-(2-nitrovinyl)phenol
- IUPAC
- 4-[(Z)-2-nitroethenyl]phenol
Names & synonyms
(Z)-4-(2-nitrovinyl)phenolAQ4RK84K4FCHEMBL39054824-(2-nitrovinyl)phenol, (Z)-4-[(1Z)-2-Nitroethenyl]phenolPhenol, 4-[(1Z)-2-nitroethenyl]-1082703-37-4(Z)-1-Hydroxy-4-(2-nitroethenyl)benzene
Database identifiers
- CAS
1082703-37-4- PubChem CID
- 15311368
- ChEMBL
CHEMBL3905482- UNII
- AQ4RK84K4F
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 177
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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