Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(OCc2ccccc2)cc1Cl- InChIKey
OZWBCJNFUZTJGD-UHFFFAOYSA-N- Molecular formula
- C13H10ClNO3
- Average molar mass
- 263.67 g/mol
- Monoisotopic mass
- 263.0349209
Names & identifiers
- Preferred name
- 4-(Benzyloxy)-2-chloro-1-nitrobenzene
- IUPAC
- 2-chloro-1-nitro-4-phenylmethoxybenzene
Names & synonyms
4-(benzyloxy)-2-chloro-1-nitrobenzene50545-45-42-chloro-1-nitro-4-phenylmethoxybenzeneSCHEMBL8699359OZWBCJNFUZTJGD-UHFFFAOYSA-Nbenzyl 3-chloro-4-nitrophenyl etherSBB102711AKOS0174430512-chloro-1-nitro-4-(phenylmethoxy)benzeneAN-068/11855017
Database identifiers
- PubChem CID
- 819861
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 276
Related reactions
5 records
Compound notes
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