![5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole structure](/static/products/7171/71712-28-2.webp)
5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole
TL;DR: 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole (CAS 71712-28-2) is a chemical compound with molecular formula C18H18O3 and molecular weight 282.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole
Also Known As: 5-[(4-methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole, 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-benzo[1,3]dioxole, 5-[(4-Methoxyphenyl)methyl]-6-(prop-2-en-1-yl)-2H-1,3-benzodioxole
| Molecular Formula | C18H18O3 |
|---|---|
| Molecular Weight | 282.13 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 282.12558 |
| Heavy Atoms | 21 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 71712-28-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC2=CC3=C(C=C2CC=C)OCO3 |
| InChIKey | FIOPFIIRLKLUCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole (CAS 71712-28-2), with molecular formula C18H18O3 and molecular weight 282.13 g/mol. IUPAC: 5-[(4-methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole.
Chemical Property Profile of 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole
Property Insights of 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole
The XLogP value of 4.7 indicates that 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole has 0 hydrogen bond donor(s) and 3 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-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole?
The CAS number of 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole is 71712-28-2.
What is the molecular formula of 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole?
The molecular formula of 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole is C18H18O3.
What is the molecular weight of 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole?
The molecular weight of 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole is 282.13 g/mol.
Where can I buy 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole?
You can request a quote for 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-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-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-Methoxyphenyl)methyl]-6-prop-2-enyl-1,3-benzodioxole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.