Diphenyl sulfoxide

CAT: 0024-sc-234781Size: 25 gDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-234781Size:25 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

945-51-7

Chemical Information

Diphenyl sulfoxide

Diphenyl sulfoxide is a sulfoxide.

CAS Number	945-51-7
PubChem CID	13679
IUPAC Name	benzenesulfinylbenzene
Molecular Formula	C12H10OS
Molecular Weight	202.27
XLogP	2.1
Topological Polar Surface Area	36.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	170

SMILES

C1=CC=C(C=C1)S(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H10OS/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H

InChIKey

JJHHIJFTHRNPIK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 945-51-7

CID: 13679

Formula: C12H10OS

MW: 202.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	202.27
XLogP3	2.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	202.04523611
Monoisotopic Mass	202.04523611
Topological Polar Surface Area	36.3 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	170
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes