Home Halogens 2-(5-chlorothiophen-2-yl)-2-oxoacetic acid

2-(5-chlorothiophen-2-yl)-2-oxoacetic acid

CAS No.:
56479-07-3
Catalog Number:
AG01BD84
Molecular Formula:
C6H3ClO3S
Molecular Weight:
190.6042
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Product Description
Catalog Number:
AG01BD84
Chemical Name:
2-(5-chlorothiophen-2-yl)-2-oxoacetic acid
CAS Number:
56479-07-3
Molecular Formula:
C6H3ClO3S
Molecular Weight:
190.6042
MDL Number:
MFCD11179657
IUPAC Name:
2-(5-chlorothiophen-2-yl)-2-oxoacetic acid
InChI:
InChI=1S/C6H3ClO3S/c7-4-2-1-3(11-4)5(8)6(9)10/h1-2H,(H,9,10)
InChI Key:
SKPUCNJHUNBQDT-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)c1ccc(s1)Cl
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.949g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.597g/mol
Monoisotopic Mass:
189.949g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
82.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties