![[1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate structure](/static/products/7468/7468-57-7.webp)
[1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate
TL;DR: [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate (CAS 7468-57-7) is a chemical compound with molecular formula C27H27IO7S and molecular weight 622.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate
Also Known As: [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate|1-(2,6-Diphenyltetrahydro-2H,6H-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl 4-methylbenzene-1-sulfonate
| Molecular Formula | C27H27IO7S |
|---|---|
| Molecular Weight | 622.05 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 88.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 622.05225 |
| Heavy Atoms | 36 |
| Complexity | 784.0 |
Chemical Identifiers
| CAS Number | 7468-57-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC(CI)C2C3C(COC(O3)C4=CC=CC=C4)OC(O2)C5=CC=CC=C5 |
| InChIKey | BAECIMNJDZDGFY-UHFFFAOYSA-N |
Product Overview
[1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate (CAS 7468-57-7), with molecular formula C27H27IO7S and molecular weight 622.05 g/mol. IUPAC: [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate.
Chemical Property Profile of [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate
Property Insights of [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate
The XLogP value of 5.1 indicates that [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.7 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate?
The CAS number of [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate is 7468-57-7.
What is the molecular formula of [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate?
The molecular formula of [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate is C27H27IO7S.
What is the molecular weight of [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate?
The molecular weight of [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate is 622.05 g/mol.
Where can I buy [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate?
You can request a quote for [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [1-(2,6-diphenyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)-2-iodoethyl] 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.