| CAS Number | 736-02-7 |
| Catalog Number | AG019NFM(AGN-PC-015SK3) |
| Chemical Name | N-[4-Amino-3-(trifluoromethyl)phenyl]benzamide |
| IUPAC Name | N-[4-amino-3-(trifluoromethyl)phenyl]benzamide |
| InChI | InChI=1S/C14H11F3N2O/c15-14(16,17)11-8-10(6-7-12(11)18)19-13(20)9-4-2-1-3-5-9/h1-8H,18H2,(H,19,20) |
| InChI Key | LWBBHILLRSDOGX-UHFFFAOYSA-N |
| MDL Number | MFCD09044387 |
| Molecular Formula | C14H11F3N2O |
| Molecular Weight | 280.2451 |
| SMILES | NC1=C(C(F)(F)F)C=C(NC(C2=CC=CC=C2)=O)C=C1 |
| Synonyms | N-[4-amino-3-(trifluoromethyl)phenyl]benzamide,
736-02-7,
AC1Q50RS,
SCHEMBL3531261,
CTK7F8413,
LWBBHILLRSDOGX-UHFFFAOYSA-N,
ZINC21958152,
AKOS000128132,
MCULE-9788549383,
NE14159,
EN300-40287,
N-benzoyl 3-(trifluoromethyl)-4-aminoaniline,
Z415636724,
|
| Complexity | 340 |
| 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