Home Sulfos Methanesulfonothioic acid, S-phenyl ester

Methanesulfonothioic acid, S-phenyl ester

CAS No.:
1197-26-8
Catalog Number:
AG000PGU
Molecular Formula:
C7H8O2S2
Molecular Weight:
188.2672
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Product Description
Catalog Number:
AG000PGU
Chemical Name:
Methanesulfonothioic acid, S-phenyl ester
CAS Number:
1197-26-8
Molecular Formula:
C7H8O2S2
Molecular Weight:
188.2672
MDL Number:
MFCD04039664
IUPAC Name:
methylsulfonylsulfanylbenzene
InChI:
InChI=1S/C7H8O2S2/c1-11(8,9)10-7-5-3-2-4-6-7/h2-6H,1H3
InChI Key:
CCUZKOLVVYXTFE-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)Sc1ccccc1
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.997g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.259g/mol
Monoisotopic Mass:
187.997g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties