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1243328-60-0

1243328-60-0 | 4-Thiazoleacetic acid, 5-chloro-2-methyl-, methyl ester

CAS No: 1243328-60-0 Catalog No: AG000LUX MDL No:

Product Description

Catalog Number:
AG000LUX
Chemical Name:
4-Thiazoleacetic acid, 5-chloro-2-methyl-, methyl ester
CAS Number:
1243328-60-0
Molecular Formula:
C7H8ClNO2S
Molecular Weight:
205.6619
IUPAC Name:
methyl 2-(5-chloro-2-methyl-1,3-thiazol-4-yl)acetate
InChI:
InChI=1S/C7H8ClNO2S/c1-4-9-5(7(8)12-4)3-6(10)11-2/h3H2,1-2H3
InChI Key:
VRPFRSBQANVKOU-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1nc(sc1Cl)C

Properties

Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.996g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.656g/mol
Monoisotopic Mass:
204.996g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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