4-{(E)-[4-(Dimethylamino)phenyl]diazenyl}benzoyl chloride
Basic information
- CAS
27128-58-1- Standard SMILES
CN(C)c1ccc(N=Nc2ccc(C(=O)Cl)cc2)cc1- InChIKey
WXFLCZCPUXDOOT-UHFFFAOYSA-N- Molecular formula
- C15H14ClN3O
- Average molar mass
- 287.74 g/mol
- Monoisotopic mass
- 287.0825398
Names & identifiers
- Preferred name
- 4-{(E)-[4-(Dimethylamino)phenyl]diazenyl}benzoyl chloride
- IUPAC
- 4-[[4-(dimethylamino)phenyl]diazenyl]benzoyl chloride
Names & synonyms
27128-58-14-((4-(Dimethylamino)phenyl)diazenyl)benzoyl chlorideNSC240870SCHEMBL2682067SCHEMBL78895324-{(E)-[4-(Dimethylamino)phenyl]diazenyl}benzoyl chlorideDTXSID50311274NSC-240870
Database identifiers
- CAS
27128-58-1- PubChem CID
- 315528
- DTXSID
DTXSID50311274- Nikkaji
- J2.256.197I
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 45 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 343
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Compound notes
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