Benzyl phenyl sulfoxide
TL;DR: Benzyl phenyl sulfoxide (CAS 833-82-9) is a chemical compound with molecular formula C13H12OS and molecular weight 216.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzenesulfinylmethylbenzene
Also Known As: Benzyl phenyl sulfoxide, (benzylsulfinyl)benzene, benzenesulfinylmethylbenzene, phenyl benzyl sulfoxide, [(BENZENESULFINYL)METHYL]BENZENE
| Molecular Formula | C13H12OS |
|---|---|
| Molecular Weight | 216.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.06088 |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 833-82-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CS(=O)C2=CC=CC=C2 |
| InChIKey | FBPGAWABXWMRAR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl phenyl sulfoxide (CAS 833-82-9), with molecular formula C13H12OS and molecular weight 216.06 g/mol. IUPAC: benzenesulfinylmethylbenzene.
Chemical Property Profile of Benzyl phenyl sulfoxide
Property Insights of Benzyl phenyl sulfoxide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl phenyl sulfoxide. With a topological polar surface area (TPSA) of 36.3 Ų, Benzyl phenyl sulfoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl phenyl sulfoxide 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 Benzyl phenyl sulfoxide?
The CAS number of Benzyl phenyl sulfoxide is 833-82-9.
What is the molecular formula of Benzyl phenyl sulfoxide?
The molecular formula of Benzyl phenyl sulfoxide is C13H12OS.
What is the molecular weight of Benzyl phenyl sulfoxide?
The molecular weight of Benzyl phenyl sulfoxide is 216.06 g/mol.
Where can I buy Benzyl phenyl sulfoxide?
You can request a quote for Benzyl phenyl sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl phenyl sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for Benzyl phenyl sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.