| CAS Number | 1394041-06-5 |
| Catalog Number | AG019ZP8 |
| Chemical Name | N-[4-(aminomethyl)phenyl]-4-fluorobenzamide hydrochloride |
| IUPAC Name | N-[4-(aminomethyl)phenyl]-4-fluorobenzamide;hydrochloride |
| InChI | InChI=1S/C14H13FN2O.ClH/c15-12-5-3-11(4-6-12)14(18)17-13-7-1-10(9-16)2-8-13;/h1-8H,9,16H2,(H,17,18);1H |
| InChI Key | XESGSIPBKRPYAA-UHFFFAOYSA-N |
| MDL Number | MFCD22375289 |
| Molecular Formula | C14H14ClFN2O |
| Molecular Weight | 280.7252 |
| SMILES | Cl.NCC1=CC=C(NC(C2=CC=C(F)C=C2)=O)C=C1 |
| Synonyms | N-[4-(aminomethyl)phenyl]-4-fluorobenzamide hydrochloride,
1394041-06-5,
NE25852,
RP29848,
|
| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 280.078g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.727g/mol |
| Monoisotopic Mass | 280.078g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number