Basic information
- CAS
329940-76-3- Standard SMILES
O=C(Nc1cccc(Cl)c1Cl)c1ccc([N+](=O)[O-])cc1Cl- InChIKey
RMAVITUDHMSPKM-UHFFFAOYSA-N- Molecular formula
- C13H7Cl3N2O3
- Average molar mass
- 345.6 g/mol
- Monoisotopic mass
- 343.952225
Names & identifiers
- Preferred name
- 2-chloro-N-(2,3-dichlorophenyl)-4-nitrobenzamide
- IUPAC
- 2-chloro-N-(2,3-dichlorophenyl)-4-nitrobenzamide
- English name
- 2-chloro-N-(2,3-dichlorophenyl)-4-nitrobenzamide
- Molecular formula
- C13H7Cl3N2O3
- Molecular weight
- 345.57
Names & synonyms
2-chloro-N-(2,3-dichlorophenyl)-4-nitrobenzamide329940-76-3Oprea1_136330Oprea1_299680STK047369AKOS000670549ST010847AG-690/11634255N-(2,3-dichlorophenyl)(2-chloro-4-nitrophenyl)carboxamideBenzamide, 2-chloro-N-(2,3-dichlorophenyl)-4-nitro-
Database identifiers
- CAS
329940-76-3- PubChem CID
- 710898
- EC Number
- 169-548-7
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 405
Physicochemical properties
- Boiling point
- 414.3 · 414.3±45.0 °C(Predicted)
- Density
- 1.599 · 1.599±0.06 g/cm3(Predicted)
- pka
- 9.8 · 9.80±0.70(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P351+P338, P337+P317, P391, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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