Products for Research Use Only

Diphenyl sulfone

CAT: 0024-sc-239801Size: 100 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0024-sc-239801Size:100 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
127-63-9

Chemical Information

Diphenyl sulfone

Diphenyl sulfone is a sulfone compound having two S-phenyl substituents. It has been found in plants like Gnidia glauca and Dioscorea bulbifera. It has a role as a plant metabolite.

CAS Number127-63-9
PubChem CID31386
IUPAC Namebenzenesulfonylbenzene
Molecular FormulaC12H10O2S
Molecular Weight218.27
XLogP2.4
Topological Polar Surface Area42.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity253
SMILES
C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2
InChI
InChI=1S/C12H10O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKey
KZTYYGOKRVBIMI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Diphenyl sulfone
CAS: 127-63-9
CID: 31386
Formula: C12H10O2S
MW: 218.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight218.27
XLogP32.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass218.04015073
Monoisotopic Mass218.04015073
Topological Polar Surface Area42.5 Ų
Heavy Atom Count15
Formal Charge0
Complexity253
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes