Basic information
- CAS
58177-49-4- Standard SMILES
CC(C(c1ccccc1)c1ccc(Cl)cc1)[N+](=O)[O-]- InChIKey
OPKFRUDNTFRUSS-UHFFFAOYSA-N- Molecular formula
- C15H14ClNO2
- Average molar mass
- 275.73 g/mol
- Monoisotopic mass
- 275.0713064
Names & identifiers
- Preferred name
- 1-Chloro-4-(2-nitro-1-phenylpropyl)benzene
- IUPAC
- 1-chloro-4-(2-nitro-1-phenylpropyl)benzene
Names & synonyms
58177-49-4NSC143982DTXSID60301525NSC144013NSC-143982NSC-144013DS-0028021-Chloro-4-(2-nitro-1-phenyl-propyl)benzene
Database identifiers
- CAS
58177-49-4- PubChem CID
- 286149
- DTXSID
DTXSID60301525
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 291
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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