Home Sulfos 2,5-dimethanesulfonylbenzoic acid

2,5-dimethanesulfonylbenzoic acid

CAS No.:
2140317-02-6
Catalog Number:
AG01EHCP
Molecular Formula:
C9H10O6S2
Molecular Weight:
278.3021
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$188
- +
5g
97%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG01EHCP
Chemical Name:
2,5-dimethanesulfonylbenzoic acid
CAS Number:
2140317-02-6
Molecular Formula:
C9H10O6S2
Molecular Weight:
278.3021
MDL Number:
MFCD31543973
IUPAC Name:
2,5-bis(methylsulfonyl)benzoic acid
InChI:
InChI=1S/C9H10O6S2/c1-16(12,13)6-3-4-8(17(2,14)15)7(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChI Key:
CEQOMJQHQGMARA-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(ccc1S(=O)(=O)C)S(=O)(=O)C
Properties
Complexity:
493  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.992g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
278.293g/mol
Monoisotopic Mass:
277.992g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties