Home Sulfos 2-(2-methanesulfonylethanesulfonyl)benzoic acid

2-(2-methanesulfonylethanesulfonyl)benzoic acid

CAS No.:
1183920-59-3
Catalog Number:
AG01BAU4
Molecular Formula:
C10H12O6S2
Molecular Weight:
292.3287
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Product Description
Catalog Number:
AG01BAU4
Chemical Name:
2-(2-methanesulfonylethanesulfonyl)benzoic acid
CAS Number:
1183920-59-3
Molecular Formula:
C10H12O6S2
Molecular Weight:
292.3287
MDL Number:
MFCD12831622
IUPAC Name:
2-(2-methylsulfonylethylsulfonyl)benzoic acid
InChI:
InChI=1S/C10H12O6S2/c1-17(13,14)6-7-18(15,16)9-5-3-2-4-8(9)10(11)12/h2-5H,6-7H2,1H3,(H,11,12)
InChI Key:
HOSLVCZIRMRQES-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1S(=O)(=O)CCS(=O)(=O)C
Properties
Complexity:
494  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.008g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
292.32g/mol
Monoisotopic Mass:
292.008g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties