| CAS Number | 346635-40-3 |
| Catalog Number | AG01DWD0 |
| Chemical Name | Propyl (2S)-2-amino-3-methylbutanoate hydrochloride |
| IUPAC Name | propyl 2-amino-3-methylbutanoate;hydrochloride |
| InChI | InChI=1S/C8H17NO2.ClH/c1-4-5-11-8(10)7(9)6(2)3;/h6-7H,4-5,9H2,1-3H3;1H |
| InChI Key | OLMSSNKDPCJKCP-UHFFFAOYSA-N |
| MDL Number | MFCD31615659 |
| Molecular Formula | C8H18ClNO2 |
| Molecular Weight | 195.6870 |
| SMILES | CC(C)[C@H](N)C(OCCC)=O.[H]Cl |
| Synonyms | propyl (2S)-2-amino-3-methylbutanoate hydrochloride,
346635-40-3,
|
| Complexity | 123 |
| 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 | 5 |
| 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
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