| CAS Number | 176543-45-6 |
| Catalog Number | AG00B33H(AGN-PC-0QAYI0) |
| Chemical Name | L-Thr-NHMe HCl |
| IUPAC Name | (2S,3R)-2-amino-3-hydroxy-N-methylbutanamide;hydrochloride |
| InChI | InChI=1S/C5H12N2O2.ClH/c1-3(8)4(6)5(9)7-2;/h3-4,8H,6H2,1-2H3,(H,7,9);1H/t3-,4+;/m1./s1 |
| InChI Key | GJEQTLUMWKOAEW-HJXLNUONSA-N |
| MDL Number | MFCD11113167 |
| Molecular Formula | C5H13ClN2O2 |
| Molecular Weight | 168.6219 |
| SMILES | Cl.CNC([C@H]([C@H](O)C)N)=O |
| Synonyms | L-THR-NHME HCL,
176543-45-6,
L-Threonine methyl amide hydrochloride,
H-L-Thr-nhme hcl,
H-THR-NHME HCL,
SCHEMBL6688692,
7348AH,
MFCD11113167,
K-5422,
C5H12N2O2.HCl,
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| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.621g/mol |
| Monoisotopic Mass | 168.067g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 75.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number