Basic information
- CAS
356765-07-6- Standard SMILES
O=C(CCC(=O)Nc1ccccc1Cl)NN=Cc1ccccc1- InChIKey
ZWKOMYUALCFNRT-UHFFFAOYSA-N- Molecular formula
- C17H16ClN3O2
- Average molar mass
- 329.8 g/mol
- Monoisotopic mass
- 329.0931045
Names & identifiers
- Preferred name
- N''-(benzalamino)-N-(2-chlorophenyl)succinamide
- IUPAC
- N'-(benzylideneamino)-N-(2-chlorophenyl)butanediamide
- English name
- 4-(2-benzylidenehydrazino)-N-(2-chlorophenyl)-4-oxobutanamide
- Molecular formula
- C17H16ClN3O2
- Molecular weight
- 329.78
Names & synonyms
MLS000701391SMR000228669BDBM81065cid_1789028HMS2569K19AKOS030662130N''-(benzalamino)-N-(2-chlorophenyl)succinamideN''-(benzylideneamino)-N-(2-chlorophenyl)butanediamideN-(2-chlorophenyl)-N''-[(phenylmethylene)amino]butanediamideN-(2-chlorophenyl)-N''-[(phenylmethylidene)amino]butanediamide4-(2-benzylidenehydrazino)-N-(2-chlorophenyl)-4-oxobutanamideButanoic acid, 4-[(2-chlorophenyl)amino]-4-oxo-, 2-(phenylmethylene)hydrazide
Database identifiers
- CAS
356765-07-6- PubChem CID
- 1789028
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 422
Physicochemical properties
- Density
- 1.23 · 1.23±0.1 g/cm3(Predicted)
- pka
- 13.22 · 13.22±0.46(Predicted)
Chemistry & industry
Suppliers2 total
ARONIS[email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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