Basic information
- Standard SMILES
O=[N+]([O-])C=Cc1ccccc1Cl- InChIKey
QHKJTRDWAZGBLR-UHFFFAOYSA-N- Molecular formula
- C8H6ClNO2
- Average molar mass
- 183.59 g/mol
Names & identifiers
- Preferred name
- o-Chloro-beta-nitrostyrene
- IUPAC
- 1-chloro-2-(2-nitroethenyl)benzene
Names & synonyms
1-chloro-2-[(1E)-2-nitroethenyl]benzeneo-chloro-beta-nitrostyreneSCHEMBL104148QHKJTRDWAZGBLR-UHFFFAOYSA-N1-Chloro-2-(2-nitro-vinyl)-benzeneAKOS026730602SY106391DB-048068F8700062-Chloro-.beta.-nitrostyrene, 2-Chloro-.omega.-nitrostyrene, 642185_ALDRICH, trans-2-Chloro-beta-nitrostyrene, Styrene, o-chloro-.beta.-nitro-, 1-chloro-2-(2-nitrovinyl)benzene, 1-Chloro-2-(2-nitrothenyl)benzene, NSC136463, ZINC00096671, Benzene, 1-chloro-2-(2-nitrothenyl)-, TL80073660, S 01393, 3156-34-1
Database identifiers
- PubChem CID
- 98458
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 188
Related reactions
5 records
Compound notes
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