Basic information
- Standard SMILES
O=C(Cl)c1ccc(Cc2ccc([N+](=O)[O-])cc2)cc1- InChIKey
CPDJGEZDJOIEMC-UHFFFAOYSA-N- Molecular formula
- C14H10ClNO3
- Average molar mass
- 275.68 g/mol
- Monoisotopic mass
- 275.0349209
Names & identifiers
- Preferred name
- 4-(4-Chlorocarbonylbenzyl)-nitrobenzene
- IUPAC
- 4-[(4-nitrophenyl)methyl]benzoyl chloride
Names & synonyms
NSC87388SCHEMBL4687395CPDJGEZDJOIEMC-UHFFFAOYSA-NNSC-873884-(4-chlorocarbonylbenzyl)-nitrobenzene
Database identifiers
- PubChem CID
- 258471
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 326
Related reactions
12 records
Compound notes
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