| CAS Number | 49706-30-1 |
| Catalog Number | AG00DCDS(AGN-PC-0OB1BY) |
| Chemical Name | Z-Thr-NHNH2 |
| IUPAC Name | benzyl N-[(2S,3R)-1-hydrazinyl-3-hydroxy-1-oxobutan-2-yl]carbamate |
| InChI | InChI=1S/C12H17N3O4/c1-8(16)10(11(17)15-13)14-12(18)19-7-9-5-3-2-4-6-9/h2-6,8,10,16H,7,13H2,1H3,(H,14,18)(H,15,17)/t8-,10+/m1/s1 |
| InChI Key | KBPKTOXMTUBNDU-SCZZXKLOSA-N |
| MDL Number | MFCD00153343 |
| Molecular Formula | C12H17N3O4 |
| Molecular Weight | 267.2811 |
| SMILES | C[C@@H](O)[C@@H](C(NN)=O)NC(OCC1=CC=CC=C1)=O |
| Synonyms | Z-L-threonine hydrazide,
49706-30-1,
Z-Thr-NHNH2,
SCHEMBL19134416,
ZINC2526274,
7936AH,
MFCD00153343,
AKOS027383344,
AM82258,
FT-0639880,
K-9230,
706Z301,
L-Threonine,N-[(phenylmethoxy)carbonyl]-, hydrazide,
benzyl (2S,3R)-1-hydrazinyl-3-hydroxy-1-oxobutan-2-ylcarbamate,
C12H17N3O4,
ZINC02526274,
CID7016358,
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| Complexity | 305 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.122g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.285g/mol |
| Monoisotopic Mass | 267.122g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 114A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
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Certificate of Analysis
Lot Number