| CAS Number | 953886-01-6 |
| Catalog Number | AG019ZHH |
| Chemical Name | 4-(aminomethyl)-N-(4-fluorophenyl)benzamide |
| IUPAC Name | 4-(aminomethyl)-N-(4-fluorophenyl)benzamide |
| InChI | InChI=1S/C14H13FN2O/c15-12-5-7-13(8-6-12)17-14(18)11-3-1-10(9-16)2-4-11/h1-8H,9,16H2,(H,17,18) |
| InChI Key | YEQITMPHTZZNGH-UHFFFAOYSA-N |
| MDL Number | MFCD09732516 |
| Molecular Formula | C14H13FN2O |
| Molecular Weight | 244.2642 |
| SMILES | NCC1=CC=C(C(NC2=CC=C(F)C=C2)=O)C=C1 |
| Synonyms | 4-(AMINOMETHYL)-N-(4-FLUOROPHENYL)BENZAMIDE,
953886-01-6,
CTK7E4339,
ZINC19722308,
AKOS000140843,
MCULE-7990599390,
NE18152,
|
| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.269g/mol |
| Monoisotopic Mass | 244.101g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number