Basic information
- Standard SMILES
O=[N+]([O-])/C=C/c1ccc(Oc2ccccc2)cc1- InChIKey
NCOKGFBCWSFFLL-ZHACJKMWSA-N- Molecular formula
- C14H11NO3
- Average molar mass
- 241.24 g/mol
Names & identifiers
- Preferred name
- 1-(2-Nitroethenyl)-4-phenoxybenzene
- IUPAC
- 1-[(E)-2-nitroethenyl]-4-phenoxybenzene
Names & synonyms
1-(2-Nitroethenyl)-4-phenoxybenzeneCHEMBL5170704936342-44-8SCHEMBL510018NCOKGFBCWSFFLL-ZHACJKMWSA-NBDBM505902331-((E)-2-Nitro-vinyl)-4-phenoxy-benzeneEN300-1871650
Database identifiers
- PubChem CID
- 19082407
- ChEMBL
CHEMBL5170704
Properties
Computed structural properties
- XLogP
- 3.8
- 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
- 284
Related reactions
10 records
Compound notes
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