Basic information
- CAS
127292-03-9- Standard SMILES
Cc1ccc(NC(=O)c2ccc(Cl)cc2)cc1C- InChIKey
SXFOCYOATNAWQS-UHFFFAOYSA-N- Molecular formula
- C15H14ClNO
- Average molar mass
- 259.73 g/mol
- Monoisotopic mass
- 259.0763918
Names & identifiers
- Preferred name
- 4-chloro-N-(3,4-dimethylphenyl)benzamide
- IUPAC
- 4-chloro-N-(3,4-dimethylphenyl)benzamide
- English name
- 4-Chloro-N-(3,4-diMethylphenyl)benzaMide, 97%
- Molecular formula
- C15H14ClNO
- Molecular weight
- 259.73
Names & synonyms
4-chloro-N-(3,4-dimethylphenyl)benzamide127292-03-9RefChem:98525starbld0003569CBDivE_001903DTXSID301277245STK033662AKOS000346411ST011828N-(3,4-dimethylphenyl)(4-chlorophenyl)carboxamideSR-010004026514-CHLORO-N-(3,4-DIMETHYL-PHENYL)-BENZAMIDE
Show more names
Benzamide, 4-chloro-N-(3,4-dimethylphenyl)-4-Chloro-N-(3,4-diMethylphenyl)benzaMide, 97%
SR-01000402651-1
Database identifiers
- CAS
127292-03-9- PubChem CID
- 720133
- DTXSID
DTXSID301277245- EC Number
- 163-588-9
Properties
Computed structural properties
- XLogP
- 4.4
- 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
- 286
Physicochemical properties
- Melting point
- 130 · 130-134 °C
- Boiling point
- 324.5 · 324.5±42.0 °C(Predicted)
- Density
- 1.22 · 1.220±0.06 g/cm3(Predicted)
- pka
- 13.15 · 13.15±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
H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, 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 CategoriesAquatic Chronic 2 (100%)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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