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Home Carboxys 2-Chloro-4-methylthiazole-5-carboxylic acid

2-Chloro-4-methylthiazole-5-carboxylic acid

CAS No.:
40003-48-3
Catalog Number:
AG007624
Molecular Formula:
C5H4ClNO2S
Molecular Weight:
177.6088
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
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Product Description
Catalog Number:
AG007624
Chemical Name:
2-Chloro-4-methylthiazole-5-carboxylic acid
CAS Number:
40003-48-3
Molecular Formula:
C5H4ClNO2S
Molecular Weight:
177.6088
MDL Number:
MFCD03848159
IUPAC Name:
2-chloro-4-methyl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C5H4ClNO2S/c1-2-3(4(8)9)10-5(6)7-2/h1H3,(H,8,9)
InChI Key:
LDUFDQVROYUUBS-UHFFFAOYSA-N
SMILES:
Clc1nc(c(s1)C(=O)O)C
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.965g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.602g/mol
Monoisotopic Mass:
176.965g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Efficient and eco-friendly preparation of 4-methyl-5-formyl-thiazole. Molecules (Basel, Switzerland) 20080421
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
Properties