| CAS Number | 926663-69-6 |
| Catalog Number | AG01AARZ(AGN-PC-02MTLY) |
| Chemical Name | N-(3-Aminophenyl)-3-(trifluoromethyl)benzamide |
| IUPAC Name | N-(3-aminophenyl)-3-(trifluoromethyl)benzamide |
| InChI | InChI=1S/C14H11F3N2O/c15-14(16,17)10-4-1-3-9(7-10)13(20)19-12-6-2-5-11(18)8-12/h1-8H,18H2,(H,19,20) |
| InChI Key | OXTAWUMXNUGWMT-UHFFFAOYSA-N |
| MDL Number | MFCD09804112 |
| Molecular Formula | C14H11F3N2O |
| Molecular Weight | 280.2451 |
| SMILES | NC1=CC(NC(C2=CC(C(F)(F)F)=CC=C2)=O)=CC=C1 |
| Synonyms | N-(3-aminophenyl)-3-(trifluoromethyl)benzamide,
926663-69-6,
CHEMBL261265,
N-(3-Aminophenyl)-3-trifluoromethylbenzamide,
N-(3-amino-phenyl)-3-trifluoromethyl-benzamide,
AC1Q51PL,
SCHEMBL2861430,
CTK7D9112,
OXTAWUMXNUGWMT-UHFFFAOYSA-N,
BDBM50376389,
ZINC19281179,
AKOS000156332,
MCULE-8066711055,
NE26582,
EN300-69406,
N-(3-Amino-phenyl)-3-trifluoromethylbenzamide,
A1-03821,
Z933381692,
|
| Complexity | 346 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 280.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.25g/mol |
| Monoisotopic Mass | 280.082g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number