| CAS Number | 144054-74-0 |
| Catalog Number | AG019YUR(AGN-PC-0O2S9Z) |
| Chemical Name | (S)-Ethyl 2-amino-3,3-dimethylbutanoate hydrochloride |
| IUPAC Name | ethyl (2S)-2-amino-3,3-dimethylbutanoate;hydrochloride |
| InChI | InChI=1S/C8H17NO2.ClH/c1-5-11-7(10)6(9)8(2,3)4;/h6H,5,9H2,1-4H3;1H/t6-;/m1./s1 |
| InChI Key | JSLXQBBNYLYHHV-FYZOBXCZSA-N |
| MDL Number | MFCD22196538 |
| Molecular Formula | C8H18ClNO2 |
| Molecular Weight | 195.6870 |
| SMILES | CC(C)(C)[C@H](N)C(OCC)=O.[H]Cl |
| Synonyms | ethyl (2S)-2-amino-3,3-dimethylbutanoate hydrochloride,
144054-74-0,
AKOS026744340,
MCULE-5455439110,
NE49067,
Z1374884848,
(S)-ethyl 2-amino-3,3-dimethylbutanoate hydrochloride,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.687g/mol |
| Monoisotopic Mass | 195.103g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number