| CAS Number | 1240528-51-1 |
| Catalog Number | AG01A9OX |
| Chemical Name | Methyl 2-amino-2-(2,5-difluorophenyl)propanoate hydrochloride |
| IUPAC Name | methyl 2-amino-2-(2,5-difluorophenyl)propanoate;hydrochloride |
| InChI | InChI=1S/C10H11F2NO2.ClH/c1-10(13,9(14)15-2)7-5-6(11)3-4-8(7)12;/h3-5H,13H2,1-2H3;1H |
| InChI Key | GHRPYMYPSPGXOQ-UHFFFAOYSA-N |
| MDL Number | MFCD16622174 |
| Molecular Formula | C10H12ClF2NO2 |
| Molecular Weight | 251.6576 |
| SMILES | Cl.COC(C(C1=C(F)C=CC(F)=C1)(N)C)=O |
| Synonyms | methyl 2-amino-2-(2,5-difluorophenyl)propanoate hydrochloride,
1240528-51-1,
AC1Q3BUE,
AKOS008142105,
MCULE-6746320873,
NE58829,
EN300-65700,
Z1262398433,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.658g/mol |
| Monoisotopic Mass | 251.052g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number