Home Halogens 4-chloro-2-(dimethylamino)-1,3-thiazole-5-carboxylic acid

4-chloro-2-(dimethylamino)-1,3-thiazole-5-carboxylic acid

CAS No.:
1514659-59-6
Catalog Number:
AG01AN8O
Molecular Formula:
C6H7ClN2O2S
Molecular Weight:
206.6500
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Product Description
Catalog Number:
AG01AN8O
Chemical Name:
4-chloro-2-(dimethylamino)-1,3-thiazole-5-carboxylic acid
CAS Number:
1514659-59-6
Molecular Formula:
C6H7ClN2O2S
Molecular Weight:
206.6500
MDL Number:
MFCD23967980
IUPAC Name:
4-chloro-2-(dimethylamino)-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C6H7ClN2O2S/c1-9(2)6-8-4(7)3(12-6)5(10)11/h1-2H3,(H,10,11)
InChI Key:
DUDVJEMJQSWUCT-UHFFFAOYSA-N
SMILES:
CN(c1nc(c(s1)C(=O)O)Cl)C
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.992g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.644g/mol
Monoisotopic Mass:
205.992g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties