5-methanesulfonylthiophene-3-carboxylic acid

5-methanesulfonylthiophene-3-carboxylic acid

Formula: C6H6O4S2

SMILES: CS(=O)(=O)C1=CC(=CS1)C(O)=O

IUPAC: 5-methanesulfonylthiophene-3-carboxylic acid

InChI: InChI=1S/C6H6O4S2/c1-12(9,10)5-2-4(3-11-5)6(7)8/h2-3H,1H3,(H,7,8)

Composition: C (34.94%), H (2.93%), O (31.03%), S (31.09%)

Molar Mass: 206.23

Atom Count: 18

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	205.970751021
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	APNHITGMDOIMJN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.58
Topological Polar Surface Area	71.44
Polarizability	17.56
Ring Count	1
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C6H6O4S2		Quote Only