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82386-41-2 | Cyclohexane, 1,1'-[methylenebis(sulfonyl)]bis-
CAS No: 82386-41-2 Catalog No: AG005BY1 MDL No:
Product Description
Catalog Number:
AG005BY1
Chemical Name:
Cyclohexane, 1,1'-[methylenebis(sulfonyl)]bis-
CAS Number:
82386-41-2
Molecular Formula:
C13H24O4S2
Molecular Weight:
308.4573
IUPAC Name:
cyclohexylsulfonylmethylsulfonylcyclohexane
InChI:
InChI=1S/C13H24O4S2/c14-18(15,12-7-3-1-4-8-12)11-19(16,17)13-9-5-2-6-10-13/h12-13H,1-11H2
InChI Key:
HAJPWFAOIWTMDL-UHFFFAOYSA-N
SMILES:
O=S(=O)(C1CCCCC1)CS(=O)(=O)C1CCCCC1
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.112g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.451g/mol
Monoisotopic Mass:
308.112g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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