3,3-Bis(benzenesulfonyl)propoxymethylbenzene
TL;DR: 3,3-Bis(benzenesulfonyl)propoxymethylbenzene (CAS 84109-68-2) is a chemical compound with molecular formula C22H22O5S2 and molecular weight 430.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-bis(benzenesulfonyl)propoxymethylbenzene
Also Known As: 3,3-bis(benzenesulfonyl)propoxymethylbenzene, 1,1'-{[3-(Benzyloxy)propane-1,1-diyl]disulfonyl}dibenzene
| Molecular Formula | C22H22O5S2 |
|---|---|
| Molecular Weight | 430.09 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 94.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 430.09088 |
| Heavy Atoms | 29 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 84109-68-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COCCC(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3 |
| InChIKey | HZDASVFLNVLFRZ-UHFFFAOYSA-N |
Product Overview
3,3-Bis(benzenesulfonyl)propoxymethylbenzene (CAS 84109-68-2), with molecular formula C22H22O5S2 and molecular weight 430.09 g/mol. IUPAC: 3,3-bis(benzenesulfonyl)propoxymethylbenzene.
Chemical Property Profile of 3,3-Bis(benzenesulfonyl)propoxymethylbenzene
Property Insights of 3,3-Bis(benzenesulfonyl)propoxymethylbenzene
The XLogP value of 4.0 indicates that 3,3-Bis(benzenesulfonyl)propoxymethylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-Bis(benzenesulfonyl)propoxymethylbenzene. Following Lipinski's Rule of Five, 3,3-Bis(benzenesulfonyl)propoxymethylbenzene has 0 hydrogen bond donor(s) and 5 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 3,3-Bis(benzenesulfonyl)propoxymethylbenzene?
The CAS number of 3,3-Bis(benzenesulfonyl)propoxymethylbenzene is 84109-68-2.
What is the molecular formula of 3,3-Bis(benzenesulfonyl)propoxymethylbenzene?
The molecular formula of 3,3-Bis(benzenesulfonyl)propoxymethylbenzene is C22H22O5S2.
What is the molecular weight of 3,3-Bis(benzenesulfonyl)propoxymethylbenzene?
The molecular weight of 3,3-Bis(benzenesulfonyl)propoxymethylbenzene is 430.09 g/mol.
Where can I buy 3,3-Bis(benzenesulfonyl)propoxymethylbenzene?
You can request a quote for 3,3-Bis(benzenesulfonyl)propoxymethylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Bis(benzenesulfonyl)propoxymethylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Bis(benzenesulfonyl)propoxymethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.