Basic information
- CAS
63793-63-5- Standard SMILES
[N-]=[N+]=CC(=O)c1c(Cl)n(-c2ccccc2)c2ccccc12- InChIKey
NPHOZFXSGSUGHP-UHFFFAOYSA-N- Molecular formula
- C16H10ClN3O
- Average molar mass
- 295.72 g/mol
- Monoisotopic mass
- 295.0512396
Names & identifiers
- Preferred name
- (Z)-1-(2-Chloro-1-phenyl-1H-indol-3-yl)-2-diazonioethen-1-olate
- IUPAC
- 1-(2-chloro-1-phenylindol-3-yl)-2-diazoethanone
Names & synonyms
63793-63-5DTXSID20421470(Z)-1-(2-Chloro-1-phenyl-1H-indol-3-yl)-2-diazonioethen-1-olateNSC247067NSC-247067
Database identifiers
- CAS
63793-63-5- PubChem CID
- 3909545
- DTXSID
DTXSID20421470
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 24 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 443
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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