[4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate
TL;DR: [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate (CAS 7595-92-8) is a chemical compound with molecular formula C21H24I2O8S2 and molecular weight 721.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate
Also Known As: [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate|4,7-Bis(iodomethyl)-6-[(4-methylbenzene-1-sulfonyl)oxy]-1,3-dioxepan-5-yl 4-methylbenzene-1-sulfonate
| Molecular Formula | C21H24I2O8S2 |
|---|---|
| Molecular Weight | 721.90 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 721.9002 |
| Heavy Atoms | 33 |
| Complexity | 742.0 |
Chemical Identifiers
| CAS Number | 7595-92-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2C(OCOC(C2OS(=O)(=O)C3=CC=C(C=C3)C)CI)CI |
| InChIKey | NXFZCVZTLZRKMF-UHFFFAOYSA-N |
Product Overview
[4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate (CAS 7595-92-8), with molecular formula C21H24I2O8S2 and molecular weight 721.90 g/mol. IUPAC: [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate.
Chemical Property Profile of [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate
Property Insights of [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate
The XLogP value of 5.0 indicates that [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate 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 [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate?
The CAS number of [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate is 7595-92-8.
What is the molecular formula of [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate?
The molecular formula of [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate is C21H24I2O8S2.
What is the molecular weight of [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate?
The molecular weight of [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate is 721.90 g/mol.
Where can I buy [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate?
You can request a quote for [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [4,7-bis(iodomethyl)-6-(4-methylphenyl)sulfonyloxy-1,3-dioxepan-5-yl] 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.