Basic information
- CAS
95690-43-0- Standard SMILES
Cc1ccc(C(=O)C=Cc2ccc(N=[N+]=[N-])cc2)cc1- InChIKey
NEJXICAUKREVML-UHFFFAOYSA-N- Molecular formula
- C16H13N3O
- Average molar mass
- 263.29 g/mol
- Monoisotopic mass
- 263.10586205
Names & identifiers
- Preferred name
- 3-(4-Azidophenyl)-1-(4-methylphenyl)prop-2-en-1-one
- IUPAC
- 3-(4-azidophenyl)-1-(4-methylphenyl)prop-2-en-1-one
Names & synonyms
95690-43-03-(4-Azidophenyl)-1-(4-methylphenyl)prop-2-en-1-oneDTXSID10709072
Database identifiers
- CAS
95690-43-0- PubChem CID
- 54106936
- DTXSID
DTXSID10709072
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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