N-(4-bromo-2-methylphenyl)-3-chlorobenzamide
Basic information
- CAS
330469-01-7- Standard SMILES
Cc1cc(Br)ccc1NC(=O)c1cccc(Cl)c1- InChIKey
FQWSGALFHVKCQX-UHFFFAOYSA-N- Molecular formula
- C14H11BrClNO
- Average molar mass
- 324.6 g/mol
- Monoisotopic mass
- 322.97125
Names & identifiers
- Preferred name
- N-(4-bromo-2-methylphenyl)-3-chlorobenzamide
- IUPAC
- N-(4-bromo-2-methylphenyl)-3-chlorobenzamide
- English name
- N-(4-bromo-2-methylphenyl)-3-chlorobenzamide
- Molecular formula
- C14H11BrClNO
- Molecular weight
- 324.6
Names & synonyms
N-(4-bromo-2-methylphenyl)-3-chlorobenzamide330469-01-7starbld0014541N-(4-Bromo-2-methyl-phenyl)-3-chloro-benzamideSTK040801AKOS000187077ST50694330AG-690/11635740N-(4-bromo-2-methylphenyl)(3-chlorophenyl)carboxamideBenzamide, N-(4-bromo-2-methylphenyl)-3-chloro-
Database identifiers
- CAS
330469-01-7- PubChem CID
- 798975
- EC Number
- 163-623-8
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 300
Physicochemical properties
- Boiling point
- 344.5 · 344.5±42.0 °C(Predicted)
- Density
- 1.525 · 1.525±0.06 g/cm3(Predicted)
- pka
- 12.15 · 12.15±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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