N-(3-chloro-4-methylphenyl)-3,5-dinitrobenzamide
Basic information
- CAS
73544-80-6- Standard SMILES
Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1Cl- InChIKey
FPWRPEFGPVSSDR-UHFFFAOYSA-N- Molecular formula
- C14H10ClN3O5
- Average molar mass
- 335.7 g/mol
- Monoisotopic mass
- 335.0308981
Overview
See also: 3'-Chloro-3,5-dinitro-4'-methylbenzanilide (annotation moved to).
Names & identifiers
- Preferred name
- N-(3-chloro-4-methylphenyl)-3,5-dinitrobenzamide
- IUPAC
- N-(3-chloro-4-methylphenyl)-3,5-dinitrobenzamide
- English name
- N-(3-Chloro-4-Methylphenyl)-3,5-dinitrobenzaMide, 97%
- Molecular formula
- C14H10ClN3O5
- Molecular weight
- 335.7
Names & synonyms
N-(3-chloro-4-methylphenyl)-3,5-dinitrobenzamide73544-80-6NSC204219Benzamide, N-(3-chloro-4-methylphenyl)-3,5-dinitro-DTXSID20308459AKOS002974132NSC-2042193'-Chloro-3,5-dinitro-p-benzotoluidideN-(3-chloro-4-methyl-phenyl)-3,5-dinitro-benzamideN-(3-Chloro-4-Methylphenyl)-3,5-dinitrobenzaMide, 97%Benzamide, N-(3-chloro-4-methylphenyl)-3,5-dinitro- (9CI)3'-CHLORO-3,5-DINITRO-4'-METHYLBENZANILIDE
Show more names
3'-CHLORO-3,5-DINITRO-4'-METHYLBENZANILIDE
Database identifiers
- CAS
73544-80-6- PubChem CID
- 306536
- DTXSID
DTXSID20308459
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 456
Physicochemical properties
- Boiling point
- 418.5 · 418.5±45.0 °C(Predicted)
- Density
- 1.524 · 1.524±0.06 g/cm3(Predicted)
- pka
- 11.09 · 11.09±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H315-H318
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
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
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H335-H315-H318
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…