![5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole structure](/static/products/6241/6241-71-0.webp)
5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole
TL;DR: 5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole (CAS 6241-71-0) is a chemical compound with molecular formula C17H18O5 and molecular weight 302.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3,4,5-trimethoxyphenyl)methyl]-1,3-benzodioxole
Also Known As: 5-[(3,4,5-trimethoxyphenyl)methyl]-1,3-benzodioxole, 5-[(3,4,5-Trimethoxyphenyl)methyl]-2H-1,3-benzodioxole
| Molecular Formula | C17H18O5 |
|---|---|
| Molecular Weight | 302.12 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 302.11542 |
| Heavy Atoms | 22 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 6241-71-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)CC2=CC3=C(C=C2)OCO3 |
| InChIKey | VAMVJLVFVYDZBM-UHFFFAOYSA-N |
Product Overview
5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole (CAS 6241-71-0), with molecular formula C17H18O5 and molecular weight 302.12 g/mol. IUPAC: 5-[(3,4,5-trimethoxyphenyl)methyl]-1,3-benzodioxole.
Chemical Property Profile of 5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole
Property Insights of 5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole
The XLogP value of 3.7 indicates that 5-[(3,4,5-Trimethoxyphenyl)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-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(3,4,5-Trimethoxyphenyl)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-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole?
The CAS number of 5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole is 6241-71-0.
What is the molecular formula of 5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole?
The molecular formula of 5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole is C17H18O5.
What is the molecular weight of 5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole?
The molecular weight of 5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole is 302.12 g/mol.
Where can I buy 5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole?
You can request a quote for 5-[(3,4,5-Trimethoxyphenyl)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-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole?
Yes, KEHONG BIO provides custom synthesis services for 5-[(3,4,5-Trimethoxyphenyl)methyl]-1,3-benzodioxole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.