3-amino-N-(4-aminophenyl)benzamide
Basic information
- CAS
2657-93-4- Standard SMILES
Nc1ccc(NC(=O)c2cccc(N)c2)cc1- InChIKey
UDKYPBUWOIPGDY-UHFFFAOYSA-N- Molecular formula
- C13H13N3O
- Average molar mass
- 227.26 g/mol
- Monoisotopic mass
- 227.10586205
Names & identifiers
- Preferred name
- 3-amino-N-(4-aminophenyl)benzamide
- IUPAC
- 3-amino-N-(4-aminophenyl)benzamide
- English name
- 3-Amino-N-(4-aminophenyl)-benzamide
- Molecular formula
- C13H13N3O
- Molecular weight
- 227.26
Names & synonyms
3-amino-N-(4-aminophenyl)benzamide2657-93-43,4'-Diamino Benzanilide3-AMINO-N-(4-AMINOPHENYL)-BENZAMIDENSC4992Oprea1_487207SCHEMBL309467SCHEMBL8776892SCHEMBL31171945DTXSID80277930NSC-4992BBL028777
Show more names
m-APABANSC 49923,4'-Diaminodiphenylamide3,4'-Diaminobenzanilide (3,4'-DABA)Benzamide, 3-amino-N-(4-aminophenyl)-
MFCD00578827STL062113AKOS005641873VS-08965CS-0323830
Database identifiers
- CAS
2657-93-4- PubChem CID
- 221114
- DTXSID
DTXSID80277930- Nikkaji
- J1.341.127A
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 81.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
Physicochemical properties
- Melting point
- 150 · 150-151 °C
- Boiling point
- 386.9 · 386.9±27.0 °C(Predicted)
- Density
- 1.314 · 1.314±0.06 g/cm3(Predicted)
- pka
- 13.33 · 13.33±0.70(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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