| CAS Number | 1038293-66-1 |
| Catalog Number | AG019X81 |
| Chemical Name | 3-Amino-2-[(4-fluorophenyl)methyl]propanamide |
| IUPAC Name | 2-(aminomethyl)-3-(4-fluorophenyl)propanamide |
| InChI | InChI=1S/C10H13FN2O/c11-9-3-1-7(2-4-9)5-8(6-12)10(13)14/h1-4,8H,5-6,12H2,(H2,13,14) |
| InChI Key | AOVNHZKZKPEZEX-UHFFFAOYSA-N |
| MDL Number | MFCD11200928 |
| Molecular Formula | C10H13FN2O |
| Molecular Weight | 196.2214 |
| SMILES | NCC(C(N)=O)CC1=CC=C(F)C=C1 |
| Synonyms | 3-amino-2-[(4-fluorophenyl)methyl]propanamide,
1038293-66-1,
AC1Q53MC,
CTK7E1996,
AKOS009271363,
MCULE-3503967655,
NE46868,
EN300-54310,
Z818727036,
|
| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.225g/mol |
| Monoisotopic Mass | 196.101g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 69.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number