Basic information
- Standard SMILES
O=C(Cl)OCc1ccccc1[N+](=O)[O-]- InChIKey
PDWUDQKIQYSAEA-UHFFFAOYSA-N- Molecular formula
- C8H6ClNO4
- Average molar mass
- 215.59 g/mol
Names & identifiers
- Preferred name
- o-Nitrobenzyl chloroformate
- IUPAC
- (2-nitrophenyl)methyl carbonochloridate
Names & synonyms
2-nitrobenzyl carbonochloridateo-nitrobenzyl chloroformate42854-99-9SCHEMBL258506PDWUDQKIQYSAEA-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 11020280
- Nikkaji
- J656.938B
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 228
Related reactions
7 records
Compound notes
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