Basic information
- CAS
16956-44-8- Standard SMILES
O=C(NNC(=O)c1ccccc1)NC(=O)c1ccccc1- InChIKey
NHXXLEBCTOQKJS-UHFFFAOYSA-N- Molecular formula
- C15H13N3O3
- Average molar mass
- 283.28 g/mol
- Monoisotopic mass
- 283.09569129
Names & identifiers
- Preferred name
- Semicarbazide, 1,4-dibenzoyl-
- IUPAC
- N-(benzamidocarbamoyl)benzamide
- English name
- 1,4-Dibenzoylsemicarbazide
- Molecular formula
- C15H13N3O3
- Molecular weight
- 283.28
Names & synonyms
1,4-DibenzoylsemicarbazideSEMICARBAZIDE, 1,4-DIBENZOYL-BRN 259529516956-44-8DTXSID701687224-09-00-00936 (Beilstein Handbook Reference)Benzoic acid, 2-[(benzoylamino)carbonyl]hydrazideBenzoic acid, 2-((benzoylamino)carbonyl)hydrazideRefChem:380113DTXCID6091213NHXXLEBCTOQKJS-UHFFFAOYSA-NN-(benzamidocarbamoyl)benzamide
Show more names
N,2-Dibenzoylhydrazinecarboxamide #N,2-Dibenzoylhydrazine-1-carboxamide
Database identifiers
- CAS
16956-44-8- PubChem CID
- 28161
- DTXSID
DTXSID70168722- Nikkaji
- J62.774G
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 87.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 386
Physicochemical properties
- Melting point
- 186 · 186-187 °C
- Density
- 1.284 · 1.284±0.06 g/cm3(Predicted)
- pka
- 9.07 · 9.07±0.43(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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