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Home Other Building Blocks 2-Thiopheneglyoxylic acid

2-Thiopheneglyoxylic acid

CAS No.:
4075-59-6
Catalog Number:
AG003HTX
Molecular Formula:
C6H4O3S
Molecular Weight:
156.1592
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$19
- +
5g
96%
In Stock USA
United States
$50
- +
10g
96%
In Stock USA
United States
$88
- +
25g
96%
In Stock USA
United States
$175
- +
100g
96%
In Stock USA
United States
$463
- +
Product Description
Catalog Number:
AG003HTX
Chemical Name:
2-Thiopheneglyoxylic acid
CAS Number:
4075-59-6
Molecular Formula:
C6H4O3S
Molecular Weight:
156.1592
MDL Number:
MFCD00005441
IUPAC Name:
2-oxo-2-thiophen-2-ylacetic acid
InChI:
InChI=1S/C6H4O3S/c7-5(6(8)9)4-2-1-3-10-4/h1-3H,(H,8,9)
InChI Key:
GIWRVUADKUVEGU-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)c1cccs1
EC Number:
223-794-2
UNII:
723A77PV2M
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.988g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.155g/mol
Monoisotopic Mass:
155.988g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
82.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
2-Oxo-2-(2-thien-yl)acetic acid. Acta crystallographica. Section E, Structure reports online 20101201
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
[Study on the synthesis, characterization of structure and fluorescence properties of the solid complex of europium ion with 1,10-phenanthroline and 2-thiopheneglyoxylic acid]. Guang pu xue yu guang pu fen xi = Guang pu 20041201
alpha-Ketocarboxylic acid-based inhibitors of protein tyrosine phosphatases. Bioorganic & medicinal chemistry letters 20010723
Properties