| CAS Number | 195070-57-6 |
| Catalog Number | AG019ZHP(AGN-PC-0QNDMM) |
| Chemical Name | Methyl 2-amino-2-(2-fluorophenyl)acetate hydrochloride |
| IUPAC Name | methyl 2-amino-2-(2-fluorophenyl)acetate;hydrochloride |
| InChI | InChI=1S/C9H10FNO2.ClH/c1-13-9(12)8(11)6-4-2-3-5-7(6)10;/h2-5,8H,11H2,1H3;1H |
| InChI Key | IVGBOUWVMMUKHE-UHFFFAOYSA-N |
| MDL Number | MFCD16661101 |
| Molecular Formula | C9H11ClFNO2 |
| Molecular Weight | 219.6405 |
| SMILES | Cl.COC(C(C1=C(F)C=CC=C1)N)=O |
| Synonyms | methyl amino(2-fluorophenyl)acetate hydrochloride,
195070-57-6,
methyl 2-amino-2-(2-fluorophenyl)acetate hydrochloride,
F2147-0629,
SCHEMBL1362477,
MFCD16661101,
AKOS016907522,
MCULE-7648270232,
NE51012,
(S)-2-AMINO-2-(3-CHLOROPHENYL)ACETICACID HCL,
(S)-2-AMINO-2-(3-CHLOROPHENYL)ACETIC ACID HYDROCHLORIDE,
N/A,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.64g/mol |
| Monoisotopic Mass | 219.046g/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