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13734-40-2

13734-40-2 | Boc-O-Tert-Butyl-L-Threonine

CAS No: 13734-40-2 Catalog No: AG0038AO MDL No:MFCD00151115

Product Description

Catalog Number:
AG0038AO
Chemical Name:
Boc-O-Tert-Butyl-L-Threonine
CAS Number:
13734-40-2
Molecular Formula:
C13H25NO5
Molecular Weight:
275.3413
MDL Number:
MFCD00151115
IUPAC Name:
(2S,3R)-3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
InChI:
InChI=1S/C13H25NO5/c1-8(18-12(2,3)4)9(10(15)16)14-11(17)19-13(5,6)7/h8-9H,1-7H3,(H,14,17)(H,15,16)/t8-,9+/m1/s1
InChI Key:
LKRXXARJBFBMCE-BDAKNGLRSA-N
SMILES:
O=C(OC(C)(C)C)N[C@@H]([C@H](OC(C)(C)C)C)C(=O)O

Properties

Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
275.173g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
275.345g/mol
Monoisotopic Mass:
275.173g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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