1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)-
TL;DR: 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)- (CAS 96573-17-0) is a chemical compound with molecular formula C14H20O5 and molecular weight 268.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethoxy-6-pentoxy-1,3-benzodioxole
Also Known As: 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)-, 4,5-dimethoxy-6-pentoxy-1,3-benzodioxole, 4,5-dimethoxy-6-pentoxy-benzo[1,3]dioxole, 4,5-dimethoxy-6-(pentyloxy)-1,3-benzodioxole, 4,5-DIMETHOXY-6-(PENTYLOXY)-2H-1,3-BENZODIOXOLE
| Molecular Formula | C14H20O5 |
|---|---|
| Molecular Weight | 268.13 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 268.13107 |
| Heavy Atoms | 19 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 96573-17-0 |
|---|---|
| SMILES | CCCCCOC1=C(C(=C2C(=C1)OCO2)OC)OC |
| InChIKey | IGXSGNHMOWTSOA-UHFFFAOYSA-N |
Product Overview
1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)- (CAS 96573-17-0), with molecular formula C14H20O5 and molecular weight 268.13 g/mol. IUPAC: 4,5-dimethoxy-6-pentoxy-1,3-benzodioxole.
Chemical Property Profile of 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)-
Property Insights of 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)-
The XLogP value of 3.4 indicates that 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)- 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 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)-?
The CAS number of 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)- is 96573-17-0.
What is the molecular formula of 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)-?
The molecular formula of 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)- is C14H20O5.
What is the molecular weight of 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)-?
The molecular weight of 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)- is 268.13 g/mol.
Where can I buy 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)-?
You can request a quote for 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzodioxole, 4,5-dimethoxy-6-(pentyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.