2,4-dichloro-N-(pyridin-3-ylmethyl)benzamide
Basic information
- CAS
314022-29-2- Standard SMILES
O=C(NCc1cccnc1)c1ccc(Cl)cc1Cl- InChIKey
GVKFTKONZPPXRC-UHFFFAOYSA-N- Molecular formula
- C13H10Cl2N2O
- Average molar mass
- 281.13 g/mol
- Monoisotopic mass
- 280.0170183
Names & identifiers
- Preferred name
- 2,4-dichloro-N-(pyridin-3-ylmethyl)benzamide
- IUPAC
- 2,4-dichloro-N-(pyridin-3-ylmethyl)benzamide
- English name
- 2,4-dichloro-N-(3-pyridinylmethyl)benzamide
- Molecular formula
- C13H10Cl2N2O
- Molecular weight
- 281.14
Names & synonyms
2,4-dichloro-N-(pyridin-3-ylmethyl)benzamide314022-29-2Benzamide, 2,4-dichloro-N-(3-pyridinylmethyl)-2,4-dichloro-N-(3-pyridinylmethyl)benzamide2,4-Dichloro-N-pyridin-3-ylmethyl-benzamideCambridge id 5338212Oprea1_013651Oprea1_845005CBDivE_015721STK412615AKOS002720656ST4009627
Show more names
ST50434013AB00081287-01AK-968/40132008(2,4-dichlorophenyl)-N-(3-pyridylmethyl)carboxamide2,4-DICHLORO-N-[(PYRIDIN-3-YL)METHYL]BENZAMIDE
Database identifiers
- CAS
314022-29-2- PubChem CID
- 689746
- EC Number
- 104-747-4
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 288
Physicochemical properties
- Boiling point
- 452.2 · 452.2±45.0 °C(Predicted)
- Density
- 1.354 · 1.354±0.06 g/cm3(Predicted)
- pka
- 12.22 · 12.22±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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