| CAS Number | 201275-09-4 |
| Catalog Number | AG00BEWC(AGN-PC-0QS0R6) |
| Chemical Name | H-D-Thr(Bzl)-NH2 HCl |
| IUPAC Name | (2R,3S)-2-amino-3-phenylmethoxybutanamide;hydrochloride |
| InChI | InChI=1S/C11H16N2O2.ClH/c1-8(10(12)11(13)14)15-7-9-5-3-2-4-6-9;/h2-6,8,10H,7,12H2,1H3,(H2,13,14);1H/t8-,10+;/m0./s1 |
| InChI Key | YIVWGOJCUBYNGK-KXNXZCPBSA-N |
| MDL Number | MFCD00237280 |
| Molecular Formula | C11H17ClN2O2 |
| Molecular Weight | 244.7179 |
| SMILES | C[C@@H]([C@H](C(=O)N)N)OCc1ccccc1.Cl |
| Synonyms | 201275-09-4,
H-D-THR(BZL)-NH2 HCL,
H-D-Thr(Bzl)-NH HCl,
H-D-Thr(Bzl)-NH2 . HCl,
H-D-Thr(Bzl)-NH2 hydrochloride,
MFCD00237280,
FT-0697957,
V4163,
K-5884,
H-D-THR -NH2HCL,
C11H16N2O2.HCl,
ACN-033626,
H-D-Thr(Bzl)-NH2 inverted exclamation mark currency HCl,
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| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.719g/mol |
| Monoisotopic Mass | 244.098g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 78.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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