Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CCn1c([N+](=O)[O-])cnc1C=Cc1ccccc1- InChIKey
ZTGZGVHBCKXXKF-UHFFFAOYSA-N- Molecular formula
- C13H13N3O2
- Average molar mass
- 243.26 g/mol
- Monoisotopic mass
- 243.10077667
Names & identifiers
- Preferred name
- beta-(1-Ethyl-5-nitro-2-imidazolyl)styrene
- IUPAC
- 1-ethyl-5-nitro-2-(2-phenylethenyl)imidazole
Names & synonyms
SCHEMBL11725489ZTGZGVHBCKXXKF-UHFFFAOYSA-Nbeta-(1-ethyl-5-nitro-2-imidazolyl)styrene
Database identifiers
- PubChem CID
- 54565136
Properties
Computed structural propertiesFilling in
- XLogP
- 3.3
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 308
Related reactions
4 records
Compound notes
Loading…