Basic information
- CAS
14379-78-3- Standard SMILES
O=C(NN=Cc1cccc([N+](=O)[O-])c1)c1ccccc1- InChIKey
SUXVRLZAKOTYFY-UHFFFAOYSA-N- Molecular formula
- C14H11N3O3
- Average molar mass
- 269.25 g/mol
- Monoisotopic mass
- 269.08004122
Names & identifiers
- Preferred name
- N-[(3-nitrophenyl)methylideneamino]benzamide
- IUPAC
- N-[(3-nitrophenyl)methylideneamino]benzamide
- English name
- Benzoic acid,2-[(3-nitrophenyl)methylene]hydrazide
- Molecular formula
- C14H11N3O3
- Molecular weight
- 269.26
Names & synonyms
CBDivE_002168SCHEMBL15917497N'-[(3-NITROPHENYL)METHYLIDENE]BENZOHYDRAZIDEBENZOIC (3-NITROBENZYLIDENE)HYDRAZIDEBenzoic acid,2-[(3-nitrophenyl)methylene]hydrazide
Database identifiers
- CAS
14379-78-3- PubChem CID
- 277752
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 87.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 372
Physicochemical properties
- Melting point
- 197 °C · 197 °C
- Density
- 1.26 · 1.26±0.1 g/cm3(Predicted)
- pka
- 11.92 · 11.92±0.46(Predicted)
Chemistry & industry
Suppliers2 total
ARONIS[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…