| CAS Number | 1021392-21-1 |
| Catalog Number | AG01C4PC |
| Chemical Name | Methyl 2-amino-4,4-dimethylpentanoate hydrochloride |
| IUPAC Name | methyl 2-amino-4,4-dimethylpentanoate;hydrochloride |
| InChI | InChI=1S/C8H17NO2.ClH/c1-8(2,3)5-6(9)7(10)11-4;/h6H,5,9H2,1-4H3;1H |
| InChI Key | BFKWVKIVRULWQS-UHFFFAOYSA-N |
| MDL Number | MFCD28895661 |
| Molecular Formula | C8H18ClNO2 |
| Molecular Weight | 195.6870 |
| SMILES | Cl.NC(C(=O)OC)CC(C)(C)C |
| Synonyms | methyl 2-amino-4,4-dimethylpentanoate hydrochloride,
1021392-21-1,
SCHEMBL18762552,
(S)-Methyl 2-amino-4,4-dimethylpentanoate hydrochloride,
Z2418194244,
79777-81-4,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| 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 | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number