| CAS Number | 251446-40-9 |
| Catalog Number | AG019W0D |
| Chemical Name | 3-amino-N-(3-fluorophenyl)benzamide |
| IUPAC Name | 3-amino-N-(3-fluorophenyl)benzamide |
| InChI | InChI=1S/C13H11FN2O/c14-10-4-2-6-12(8-10)16-13(17)9-3-1-5-11(15)7-9/h1-8H,15H2,(H,16,17) |
| InChI Key | NTRUKPPSBDQENE-UHFFFAOYSA-N |
| MDL Number | MFCD09740758 |
| Molecular Formula | C13H11FN2O |
| Molecular Weight | 230.2376 |
| SMILES | NC1=CC(C(NC2=CC(F)=CC=C2)=O)=CC=C1 |
| Synonyms | 3-amino-N-(3-fluorophenyl)benzamide,
251446-40-9,
AC1Q51ES,
SCHEMBL1353546,
CTK7C1989,
NTRUKPPSBDQENE-UHFFFAOYSA-N,
ZINC19255858,
AKOS000146932,
MCULE-9911103110,
NE14379,
3-amino-N-(3-fluoro-phenyl)-benzamide,
EN300-50046,
|
| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.242g/mol |
| Monoisotopic Mass | 230.086g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number