5-chloro-N-(4-chlorobenzyl)-2-nitrobenzenecarboxamide
Basic information
- CAS
478249-19-3- Standard SMILES
O=C(NCc1ccc(Cl)cc1)c1cc(Cl)ccc1[N+](=O)[O-]- InChIKey
GVYCQHLHHFWHNR-UHFFFAOYSA-N- Molecular formula
- C14H10Cl2N2O3
- Average molar mass
- 325.1 g/mol
- Monoisotopic mass
- 324.0068476
Names & identifiers
- Preferred name
- 5-chloro-N-(4-chlorobenzyl)-2-nitrobenzenecarboxamide
- IUPAC
- 5-chloro-N-[(4-chlorophenyl)methyl]-2-nitrobenzamide
- English name
- 5-Chloro-N-(4-chlorobenzyl)-2-nitrobenzenecarboxamide
- Molecular formula
- C14H10Cl2N2O3
- Molecular weight
- 325.15
Names & synonyms
478249-19-35-chloro-N-(4-chlorobenzyl)-2-nitrobenzenecarboxamide5-chloro-N-[(4-chlorophenyl)methyl]-2-nitrobenzamide5-Chloro-N-(4-chlorobenzyl)-2-nitrobenzamideOprea1_839633DTXSID701220684MFCD02571482AKOS003865893CS-03671399R-02355-chloro-N-[(4-chlorophenyl)methyl]-2-nitro-benzamideBenzamide, 5-chloro-N-[(4-chlorophenyl)methyl]-2-nitro-
Database identifiers
- CAS
478249-19-3- PubChem CID
- 1489181
- DTXSID
DTXSID701220684
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 381
Physicochemical properties
- Boiling point
- 481.6 · 481.6±45.0 °C(Predicted)
- Density
- 1.437 · 1.437±0.06 g/cm3(Predicted)
- pka
- 12.44 · 12.44±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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