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122590-93-6

122590-93-6 | Benzene, [[difluoro(phenylsulfonyl)methyl]thio]-

CAS No: 122590-93-6 Catalog No: AG0017I1 MDL No:

Product Description

Catalog Number:
AG0017I1
Chemical Name:
Benzene, [[difluoro(phenylsulfonyl)methyl]thio]-
CAS Number:
122590-93-6
Molecular Formula:
C13H10F2O2S2
Molecular Weight:
300.3441
IUPAC Name:
[benzenesulfonyl(difluoro)methyl]sulfanylbenzene
InChI:
InChI=1S/C13H10F2O2S2/c14-13(15,18-11-7-3-1-4-8-11)19(16,17)12-9-5-2-6-10-12/h1-10H
InChI Key:
OJZZBVMYMHQPDV-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)c1ccccc1)(Sc1ccccc1)F

Properties

Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.009g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.338g/mol
Monoisotopic Mass:
300.009g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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