| CAS Number | 959750-74-4 |
| Catalog Number | AG01C41V |
| Chemical Name | tert-Butyl (R)-2-aminobutanoate hydrochloride |
| IUPAC Name | tert-butyl (2R)-2-aminobutanoate |
| InChI | InChI=1S/C8H17NO2/c1-5-6(9)7(10)11-8(2,3)4/h6H,5,9H2,1-4H3/t6-/m1/s1 |
| InChI Key | UZHNWSLHLJLEAZ-ZCFIWIBFSA-N |
| MDL Number | MFCD08275809 |
| Molecular Formula | C8H18ClNO2 |
| Molecular Weight | 195.6870 |
| SMILES | Cl.N[C@@H](C(=O)OC(C)(C)C)CC |
| Synonyms | tert-butyl (2R)-2-aminobutanoate,
H-D-Abu-OtBu . HCl,
H-D-Abu-OtBu,
SCHEMBL1952044,
MFCD08275809,
ZINC37729932,
AKOS013465886,
MCULE-2572146353,
NE27741,
959750-74-4,
Z1436181069,
313994-32-0,
D-2-Aminobutyric acid tert-butyl ester hydrochloride,
Butanoic acid, 2-amino-, 1,1-dimethylethyl ester, (2R)- (9CI),
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.229g/mol |
| Monoisotopic Mass | 159.126g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number