二苯基亚砜
TL;DR: 二苯基亚砜 (CAS 945-51-7) is a chemical compound with molecular formula C12H10OS and molecular weight 202.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二苯基亚砜
benzenesulfinylbenzene
Also Known As: Diphenyl sulfoxide, Phenyl sulfoxide, sulfinyldibenzene, Diphenylsulfoxide, Diphenyl sulphoxide
| Molecular Formula | C12H10OS |
|---|---|
| Molecular Weight | 202.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.04524 |
| Heavy Atoms | 14 |
| Complexity | 170.0 |
| Vapor Pressure | 0.0000362 [mmHg] |
Chemical Identifiers
| CAS Number | 945-51-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)C2=CC=CC=C2 |
| InChIKey | JJHHIJFTHRNPIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二苯基亚砜 (CAS 945-51-7), with molecular formula C12H10OS and molecular weight 202.05 g/mol. IUPAC: benzenesulfinylbenzene.
Chemical Property Profile of 二苯基亚砜
Property Insights of 二苯基亚砜
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二苯基亚砜. With a topological polar surface area (TPSA) of 36.3 Ų, 二苯基亚砜 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二苯基亚砜 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
Frequently Asked Questions
What is the CAS number of 二苯基亚砜?
The CAS number of 二苯基亚砜 is 945-51-7.
What is the molecular formula of 二苯基亚砜?
The molecular formula of 二苯基亚砜 is C12H10OS.
What is the molecular weight of 二苯基亚砜?
The molecular weight of 二苯基亚砜 is 202.05 g/mol.
Where can I buy 二苯基亚砜?
You can request a quote for 二苯基亚砜 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二苯基亚砜?
Yes, KEHONG BIO provides custom synthesis services for 二苯基亚砜 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.