![(2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate structure](/static/products/1094/1094-91-3.webp)
(2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate
TL;DR: (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate (CAS 1094-91-3) is a chemical compound with molecular formula C16H16O5S and molecular weight 320.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydro-1,4-benzodioxin-3-ylmethyl 4-methylbenzenesulfonate
Also Known As: Maybridge1_005281, 2-tosyloxymethyl-1,4-benzodioxane, 2-tosyloxymethyl-1,4-benzodioxan, (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate, (1,4-benzodioxan-2-yl)methyl tosylate
| Molecular Formula | C16H16O5S |
|---|---|
| Molecular Weight | 320.07 g/mol |
| LogP | 2.54032 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.07184 |
| Heavy Atoms | 22 |
| Complexity | 752.36053 |
Chemical Identifiers
| CAS Number | 1094-91-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC2COC3=CC=CC=C3O2 |
Product Overview
(2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate (CAS 1094-91-3), with molecular formula C16H16O5S and molecular weight 320.07 g/mol. IUPAC: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 4-methylbenzenesulfonate.
Chemical Property Profile of (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate
Property Insights of (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate
The XLogP value of 2.54032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate 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 (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate?
The CAS number of (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate is 1094-91-3.
What is the molecular formula of (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate?
The molecular formula of (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate is C16H16O5S.
What is the molecular weight of (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate?
The molecular weight of (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate is 320.07 g/mol.
Where can I buy (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate?
You can request a quote for (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.