3-isobutoxy-N-[3-(trifluoromethyl)phenyl]benzamide
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Basic information
- CAS
461034-82-2- Standard SMILES
CC(C)COc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1- InChIKey
ABAOTCBCAUJIQT-UHFFFAOYSA-N- Molecular formula
- C18H18F3NO2
- Average molar mass
- 337.3 g/mol
- Monoisotopic mass
- 337.1289633
Names & identifiers
- Preferred name
- 3-isobutoxy-N-[3-(trifluoromethyl)phenyl]benzamide
- IUPAC
- 3-(2-methylpropoxy)-N-[3-(trifluoromethyl)phenyl]benzamide
- English name
- 3-isobutoxy-N-[3-(trifluoromethyl)phenyl]benzamide
- Molecular formula
- C18H18F3NO2
- Molecular weight
- 337.3362296
Names & synonyms
3-isobutoxy-N-[3-(trifluoromethyl)phenyl]benzamide3-(2-methylpropoxy)-N-[3-(trifluoromethyl)phenyl]benzamideSTK155756AKOS000459188NCGC00341776-01ST50943956AB01334259-02AH-487/41974427[3-(2-methylpropoxy)phenyl]-N-[3-(trifluoromethyl)phenyl]carboxamide
Database identifiers
- CAS
461034-82-2- PubChem CID
- 900450
Properties
Computed structural propertiesFilling in
- XLogP
- 4.9
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 412
Related reactions
0 records
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Compound notes
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