N-(1-anilino-1-oxohexa-2,4-dien-2-yl)benzamide
Basic information
- CAS
418797-19-0- Standard SMILES
CC=CC=C(NC(=O)c1ccccc1)C(=O)Nc1ccccc1- InChIKey
CPZFPALHZKINHU-UHFFFAOYSA-N- Molecular formula
- C19H18N2O2
- Average molar mass
- 306.4 g/mol
- Monoisotopic mass
- 306.13682782
Names & identifiers
- Preferred name
- N-(1-anilino-1-oxohexa-2,4-dien-2-yl)benzamide
- IUPAC
- N-(1-anilino-1-oxohexa-2,4-dien-2-yl)benzamide
- English name
- Benzamide, N-[1-[(phenylamino)carbonyl]-1,3-pentadienyl]- (9CI)
- Molecular formula
- C19H18N2O2
- Molecular weight
- 306.36
Names & synonyms
AC1MEFHEN-(1-anilino-1-oxohexa-2,4-dien-2-yl)benzamideDTXSID90386168Benzamide, N-[1-[(phenylamino)carbonyl]-1,3-pentadien-1-yl]-Benzamide, N-[1-[(phenylamino)carbonyl]-1,3-pentadienyl]- (9CI)
Database identifiers
- CAS
418797-19-0- PubChem CID
- 2854367
- DTXSID
DTXSID90386168
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 456
Physicochemical properties
- Boiling point
- 594.7 · 594.7±46.0 °C(Predicted)
- Density
- 1.176 · 1.176±0.06 g/cm3(Predicted)
- pka
- 11.59 · 11.59±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…