1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene
TL;DR: 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene (CAS 3561-68-0) is a chemical compound with molecular formula C27H24O8S4 and molecular weight 604.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,3-tris(benzenesulfonyl)propylsulfonylbenzene
Also Known As: 1,3,3-tris(benzenesulfonyl)propylsulfonylbenzene, 1,1,3,3-Tetrakis-phenylsulfonyl-propan, 1,1,3,3-Tetrakis(phenylsulfonyl)propane, J2.233.302J, [1,3,3-tris(benzenesulfonyl)propanesulfonyl]benzene
| Molecular Formula | C27H24O8S4 |
|---|---|
| Molecular Weight | 604.04 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 604.0354 |
| Heavy Atoms | 39 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 3561-68-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)C(CC(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4 |
| InChIKey | QUBYTVNIITXXNX-UHFFFAOYSA-N |
Product Overview
1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene (CAS 3561-68-0), with molecular formula C27H24O8S4 and molecular weight 604.04 g/mol. IUPAC: 1,3,3-tris(benzenesulfonyl)propylsulfonylbenzene.
Chemical Property Profile of 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene
Property Insights of 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene
The XLogP value of 4.6 indicates that 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 170.0 Ų indicates high polarity, suggesting 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene?
The CAS number of 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene is 3561-68-0.
What is the molecular formula of 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene?
The molecular formula of 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene is C27H24O8S4.
What is the molecular weight of 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene?
The molecular weight of 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene is 604.04 g/mol.
Where can I buy 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene?
You can request a quote for 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3,3-Tris(benzenesulfonyl)propylsulfonylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.