5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole
TL;DR: 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole (CAS 6303-39-5) is a chemical compound with molecular formula C14H20O4 and molecular weight 252.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1-butoxyethoxymethyl)-1,3-benzodioxole
Also Known As: 5-[(1-butoxyethoxy)methyl]-1,3-benzodioxole, 5-(1-butoxyethoxymethyl)-1,3-benzodioxole, 1,3-Benzodioxole,5-[(1-butoxyethoxy)methyl]-, 5-(1-Butoxy-aethoxymethyl)-benzo[1,3]dioxol, 5-[(1-BUTOXYETHOXY)METHYL]-2H-1,3-BENZODIOXOLE
| Molecular Formula | C14H20O4 |
|---|---|
| Molecular Weight | 252.14 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 252.13615 |
| Heavy Atoms | 18 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 6303-39-5 |
|---|---|
| SMILES | CCCCOC(C)OCC1=CC2=C(C=C1)OCO2 |
| InChIKey | ORUDRKSTTQKZCG-UHFFFAOYSA-N |
Product Overview
5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole (CAS 6303-39-5), with molecular formula C14H20O4 and molecular weight 252.14 g/mol. IUPAC: 5-(1-butoxyethoxymethyl)-1,3-benzodioxole.
Chemical Property Profile of 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole
Property Insights of 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole
The XLogP value of 3.2 indicates that 5-[(1-Butoxyethoxy)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 36.9 Ų, 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole has 0 hydrogen bond donor(s) and 4 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-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole?
The CAS number of 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole is 6303-39-5.
What is the molecular formula of 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole?
The molecular formula of 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole is C14H20O4.
What is the molecular weight of 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole?
The molecular weight of 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole is 252.14 g/mol.
Where can I buy 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole?
You can request a quote for 5-[(1-Butoxyethoxy)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-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole?
Yes, KEHONG BIO provides custom synthesis services for 5-[(1-Butoxyethoxy)methyl]-1,3-benzodioxole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.