4-chloro-N-(2-chloro-5-nitrophenyl)benzamide
Basic information
- CAS
313981-26-9- Standard SMILES
O=C(Nc1cc([N+](=O)[O-])ccc1Cl)c1ccc(Cl)cc1- InChIKey
YNCSUQIVSHCHMF-UHFFFAOYSA-N- Molecular formula
- C13H8Cl2N2O3
- Average molar mass
- 311.12 g/mol
- Monoisotopic mass
- 309.9911975
Names & identifiers
- Preferred name
- 4-chloro-N-(2-chloro-5-nitrophenyl)benzamide
- IUPAC
- 4-chloro-N-(2-chloro-5-nitrophenyl)benzamide
- English name
- 4-chloro-N-(2-chloro-5-nitrophenyl)benzamide
- Molecular formula
- C13H8Cl2N2O3
- Molecular weight
- 311.12
Names & synonyms
4-chloro-N-(2-chloro-5-nitrophenyl)benzamideOprea1_233320SCHEMBL15668406YNCSUQIVSHCHMF-UHFFFAOYSA-NSTK094831AKOS001603953ST011826AB00081641-01AK-968/11164279SR-01000406872SR-01000406872-1N-(2-chloro-5-nitrophenyl)(4-chlorophenyl)carboxamide
Show more names
Benzamide, 4-chloro-N-(2-chloro-5-nitrophenyl)-
4-CHLORO-N-(2-CHLORO-5-NITRO-PHENYL)-BENZAMIDE313981-26-9
Database identifiers
- CAS
313981-26-9- PubChem CID
- 720125
- EC Number
- 163-587-3
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 367
Physicochemical properties
- Boiling point
- 368.2 · 368.2±42.0 °C(Predicted)
- Density
- 1.524 · 1.524±0.06 g/cm3(Predicted)
- pka
- 11.29 · 11.29±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%)
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Related reactions
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Compound notes
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