Home Carboxys 2-Thiazolecarboxylic acid, 4-hydroxy-5-methyl-

2-Thiazolecarboxylic acid, 4-hydroxy-5-methyl-

CAS No.:
133833-94-0
Catalog Number:
AG00A8DW
Molecular Formula:
C5H5NO3S
Molecular Weight:
159.1631
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Product Description
Catalog Number:
AG00A8DW
Chemical Name:
2-Thiazolecarboxylic acid, 4-hydroxy-5-methyl-
CAS Number:
133833-94-0
Molecular Formula:
C5H5NO3S
Molecular Weight:
159.1631
MDL Number:
MFCD18817023
IUPAC Name:
4-hydroxy-5-methyl-1,3-thiazole-2-carboxylic acid
InChI:
InChI=1S/C5H5NO3S/c1-2-3(7)6-4(10-2)5(8)9/h7H,1H3,(H,8,9)
InChI Key:
XWZZGBAAPWOSNW-UHFFFAOYSA-N
SMILES:
OC(=O)c1nc(c(s1)C)O
Properties
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.999g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
159.159g/mol
Monoisotopic Mass:
158.999g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
98.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties