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101759-72-2 | L-Threonine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-
CAS No: 101759-72-2 Catalog No: AG0005EE MDL No:MFCD02259477
Product Description
Catalog Number:
AG0005EE
Chemical Name:
L-Threonine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-
CAS Number:
101759-72-2
Molecular Formula:
C10H19NO5
Molecular Weight:
233.2616
MDL Number:
MFCD02259477
IUPAC Name:
(2S,3R)-3-hydroxy-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]butanoic acid
InChI:
InChI=1S/C10H19NO5/c1-6(12)7(8(13)14)11(5)9(15)16-10(2,3)4/h6-7,12H,1-5H3,(H,13,14)/t6-,7+/m1/s1
InChI Key:
NHXZARPGSOCYMJ-RQJHMYQMSA-N
SMILES:
C[C@H]([C@H](N(C(=O)OC(C)(C)C)C)C(=O)O)O
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
233.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
233.264g/mol
Monoisotopic Mass:
233.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
87.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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