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Home Other Building Blocks 2-(2-Aminothiazol-4-yl)-2-oxoacetic acid

2-(2-Aminothiazol-4-yl)-2-oxoacetic acid

CAS No.:
73150-67-1
Catalog Number:
AG0063Q4
Molecular Formula:
C5H4N2O3S
Molecular Weight:
172.1619
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Product Description
Catalog Number:
AG0063Q4
Chemical Name:
2-(2-Aminothiazol-4-yl)-2-oxoacetic acid
CAS Number:
73150-67-1
Molecular Formula:
C5H4N2O3S
Molecular Weight:
172.1619
MDL Number:
MFCD00274532
IUPAC Name:
2-(2-amino-1,3-thiazol-4-yl)-2-oxoacetic acid
InChI:
InChI=1S/C5H4N2O3S/c6-5-7-2(1-11-5)3(8)4(9)10/h1H,(H2,6,7)(H,9,10)
InChI Key:
VMASTYPGLHRVNL-UHFFFAOYSA-N
SMILES:
Nc1nc(cs1)C(=O)C(=O)O
EC Number:
277-301-0
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.994g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
172.158g/mol
Monoisotopic Mass:
171.994g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties