Home Sulfos 3-Thiophenecarboxylic acid, 2-(methylsulfonyl)-

3-Thiophenecarboxylic acid, 2-(methylsulfonyl)-

CAS No.:
71154-33-1
Catalog Number:
AG006BD0
Molecular Formula:
C6H6O4S2
Molecular Weight:
206.2394
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Product Description
Catalog Number:
AG006BD0
Chemical Name:
3-Thiophenecarboxylic acid, 2-(methylsulfonyl)-
CAS Number:
71154-33-1
Molecular Formula:
C6H6O4S2
Molecular Weight:
206.2394
MDL Number:
MFCD06617853
IUPAC Name:
2-methylsulfonylthiophene-3-carboxylic acid
InChI:
InChI=1S/C6H6O4S2/c1-12(9,10)6-4(5(7)8)2-3-11-6/h2-3H,1H3,(H,7,8)
InChI Key:
LTSDARSWFCHOEY-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccsc1S(=O)(=O)C
Properties
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.971g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.23g/mol
Monoisotopic Mass:
205.971g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties