N-(4-bromo-3-methylphenyl)-4-methoxybenzamide
Basic information
- CAS
111142-32-6- Standard SMILES
COc1ccc(C(=O)Nc2ccc(Br)c(C)c2)cc1- InChIKey
NBPJLIZBSDOIQS-UHFFFAOYSA-N- Molecular formula
- C15H14BrNO2
- Average molar mass
- 320.18 g/mol
- Monoisotopic mass
- 319.02079
Names & identifiers
- Preferred name
- N-(4-bromo-3-methylphenyl)-4-methoxybenzamide
- IUPAC
- N-(4-bromo-3-methylphenyl)-4-methoxybenzamide
- English name
- N-(4-bromo-3-methylphenyl)-4-methoxybenzamide
- Molecular formula
- C15H14BrNO2
- Molecular weight
- 320.18
Names & synonyms
N-(4-bromo-3-methylphenyl)-4-methoxybenzamide111142-32-6starbld0003820Cambridge id 5537229Oprea1_395593Oprea1_857148STK039040AKOS000196407ST010675AB00087930-01Z30826502N-(4-bromo-3-methylphenyl)(4-methoxyphenyl)carboxamide
Show more names
Benzamide, N-(4-bromo-3-methylphenyl)-4-methoxy-
Database identifiers
- CAS
111142-32-6- PubChem CID
- 710659
- EC Number
- 169-443-6
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 303
Physicochemical properties
- Boiling point
- 357.7 · 357.7±42.0 °C(Predicted)
- Density
- 1.424 · 1.424±0.06 g/cm3(Predicted)
- pka
- 12.77 · 12.77±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
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute 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 Acute 1 (100%)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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