Basic information
- Standard SMILES
O=[N+]([O-])[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1- InChIKey
YFNSKRWAVGCAHS-CVEARBPZSA-N- Molecular formula
- C16H15NO3
- Average molar mass
- 269.29 g/mol
Names & identifiers
- Preferred name
- 1-(benzyloxy)-4-((1R,2S)-2-nitrocyclopropyl)benzene
- IUPAC
- 1-[(1R,2S)-2-nitrocyclopropyl]-4-phenylmethoxybenzene
Names & synonyms
1-(benzyloxy)-4-((1R,2S)-2-nitrocyclopropyl)benzene1221595-64-71-[(1R,2S)-2-nitrocyclopropyl]-4-phenylmethoxybenzene1-(benzyloxy)-4-[(1R,2S)-2-nitrocyclopropyl]benzeneSCHEMBL238263YFNSKRWAVGCAHS-CVEARBPZSA-N
Database identifiers
- PubChem CID
- 66629583
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 327
Related reactions
5 records
Compound notes
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