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7536-58-5

7536-58-5 | Boc-Asp(Obzl)-OH

CAS No: 7536-58-5 Catalog No: AG0038GO MDL No:MFCD00065564

Product Description

Catalog Number:
AG0038GO
Chemical Name:
Boc-Asp(Obzl)-OH
CAS Number:
7536-58-5
Molecular Formula:
C16H21NO6
Molecular Weight:
323.3410
MDL Number:
MFCD00065564
IUPAC Name:
(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-4-phenylmethoxybutanoic acid
InChI:
InChI=1S/C16H21NO6/c1-16(2,3)23-15(21)17-12(14(19)20)9-13(18)22-10-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,19,20)/t12-/m0/s1
InChI Key:
SOHLZANWVLCPHK-LBPRGKRZSA-N
SMILES:
O=C(C[C@@H](C(=O)O)NC(=O)OC(C)(C)C)OCc1ccccc1
EC Number:
231-406-8

Properties

Complexity:
423  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
323.137g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
323.345g/mol
Monoisotopic Mass:
323.137g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

Literature

Title Journal
Transesterification and amide cis-trans isomerization in Zn and Cd complexes of the chelating amino acid ligand Boc-Asp(Dpa)-OBzl. Dalton transactions (Cambridge, England : 2003) 20070107
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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