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Diphenyl sulfone structure
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Diphenyl sulfone

TL;DR: Diphenyl sulfone (CAS 127-63-9) is a chemical compound with molecular formula C12H10O2S and molecular weight 218.04015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

benzenesulfonylbenzene

Also Known As: Diphenyl sulfone, Sulfonyldibenzene, Phenyl sulfone, Sulfobenzide, DIPHENYLSULFONE

CAS Number
127-63-9
Molecular Formula
C12H10O2S
Molecular Weight
218.04015 g/mol
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Application Areas

Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (220 patents) Analytical Reagents (99 patents) Biotechnology (76 patents) Catalysts (253 patents) Coatings & Adhesives (515 patents)

Technical Specifications

Molecular FormulaC12H10O2S
Molecular Weight218.04015 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)42.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass218.04015 Da
Heavy Atoms15
Complexity253.0
Vapor Pressure0.0000153 [mmHg]
SMILESC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2
InChIKeyKZTYYGOKRVBIMI-UHFFFAOYSA-N

Chemical Property Profile of Diphenyl sulfone

XLogP
2.4
TPSA (Topological Polar Surface Area)
42.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
15
Complexity
253.0
Exact Mass
218.04015
Monoisotopic Mass
218.04015
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Diphenyl sulfone

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diphenyl sulfone. With a topological polar surface area (TPSA) of 42.5 Ų, Diphenyl sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenyl sulfone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Diphenyl sulfone?

The CAS number of Diphenyl sulfone is 127-63-9.

What is the molecular formula of Diphenyl sulfone?

The molecular formula of Diphenyl sulfone is C12H10O2S.

What is the molecular weight of Diphenyl sulfone?

The molecular weight of Diphenyl sulfone is 218.04015 g/mol.

Where can I buy Diphenyl sulfone?

You can request a quote for Diphenyl sulfone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Diphenyl sulfone?

Yes, CoreyChem provides custom synthesis services for Diphenyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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