Basic information
- Standard SMILES
O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)OCc1ccccc1- InChIKey
SMXGADWNKGMRKB-UHFFFAOYSA-N- Molecular formula
- C14H11ClN2O4
- Average molar mass
- 306.7 g/mol
Names & identifiers
- Preferred name
- benzyl N-(4-chloro-3-nitrophenyl)carbamate
- IUPAC
- benzyl N-(4-chloro-3-nitrophenyl)carbamate
Names & synonyms
benzyl N-(4-chloro-3-nitrophenyl)carbamate413577-45-4SCHEMBL906526SMXGADWNKGMRKB-UHFFFAOYSA-NAKOS003446316benzyl 4-chloro-3-nitrophenylcarbamateN-benzyloxycarbonyl-4-chloro-3-nitroanilineEN300-12692824
Database identifiers
- PubChem CID
- 4935650
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 368
Related reactions
3 records
Compound notes
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