![5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole structure](/static/products/3136/31368-19-1.webp)
5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole
TL;DR: 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole (CAS 31368-19-1) is a chemical compound with molecular formula C16H23BrO5 and molecular weight 374.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-6-[2-(2-butoxyethoxy)ethoxymethyl]-1,3-benzodioxole
Also Known As: 5-bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole, 5-bromo-6-[2-(2-butoxyethoxy)ethoxymethyl]-1,3-benzodioxole, 1,3-Benzodioxole,5-bromo-6-[[2-(2-butoxyethoxy)ethoxy]methyl]-, 5-BROMO-6-{[2-(2-BUTOXYETHOXY)ETHOXY]METHYL}-2H-1,3-BENZODIOXOLE
| Molecular Formula | C16H23BrO5 |
|---|---|
| Molecular Weight | 374.07 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 374.07288 |
| Heavy Atoms | 22 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 31368-19-1 |
|---|---|
| SMILES | CCCCOCCOCCOCC1=CC2=C(C=C1Br)OCO2 |
| InChIKey | VQJILJLOTBUSBY-UHFFFAOYSA-N |
Product Overview
5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole (CAS 31368-19-1), with molecular formula C16H23BrO5 and molecular weight 374.07 g/mol. IUPAC: 5-bromo-6-[2-(2-butoxyethoxy)ethoxymethyl]-1,3-benzodioxole.
Chemical Property Profile of 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole
Property Insights of 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole
The XLogP value of 3.0 indicates that 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole 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 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole?
The CAS number of 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole is 31368-19-1.
What is the molecular formula of 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole?
The molecular formula of 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole is C16H23BrO5.
What is the molecular weight of 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole?
The molecular weight of 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole is 374.07 g/mol.
Where can I buy 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole?
You can request a quote for 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-6-{[2-(2-butoxyethoxy)ethoxy]methyl}-1,3-benzodioxole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.