3,5-dimethoxy-N-phenylbenzamide
Basic information
- CAS
87282-04-0- Standard SMILES
COc1cc(OC)cc(C(=O)Nc2ccccc2)c1- InChIKey
ISUQCAAJIKTSIX-UHFFFAOYSA-N- Molecular formula
- C15H15NO3
- Average molar mass
- 257.28 g/mol
- Monoisotopic mass
- 257.10519334
Names & identifiers
- Preferred name
- 3,5-dimethoxy-N-phenylbenzamide
- IUPAC
- 3,5-dimethoxy-N-phenylbenzamide
- English name
- 3,5-dimethoxy-N-phenylbenzamide
- Molecular formula
- C15H15NO3
- Molecular weight
- 257.28
Names & synonyms
3,5-dimethoxy-N-phenylbenzamide87282-04-0Oprea1_541148ghl.PD_Mitscher_leg0.6623,5-Dimethoxy-benzoyl-anilinSCHEMBL3956696(3,5-dimethoxyphenyl)-N-benzamideSTK036491AKOS000649452ST50334443AN-652/11534347Z27782749
Show more names
Benzamide, 3,5-dimethoxy-N-phenyl-
Database identifiers
- CAS
87282-04-0- PubChem CID
- 835447
- EC Number
- 123-745-4
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 277
Physicochemical properties
- Boiling point
- 348.2 · 348.2±32.0 °C(Predicted)
- Density
- 1.189 · 1.189±0.06 g/cm3(Predicted)
- pka
- 13.29 · 13.29±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
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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