3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane
TL;DR: 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane (CAS 4468-39-7) is a chemical compound with molecular formula C21H28O2 and molecular weight 312.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-ethyl-3-(4-methoxyphenyl)pentyl]-4-methoxybenzene
Also Known As: Compound 77/735, CDRI 77/735, 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane, 1-[2-ethyl-3-(4-methoxyphenyl)pentyl]-4-methoxybenzene, 3-06-00-05532 (Beilstein Handbook Reference)
| Molecular Formula | C21H28O2 |
|---|---|
| Molecular Weight | 312.21 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 312.20892 |
| Heavy Atoms | 23 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 4468-39-7 |
|---|---|
| SMILES | CCC(CC1=CC=C(C=C1)OC)C(CC)C2=CC=C(C=C2)OC |
| InChIKey | VTMTVAPRBUVDRK-UHFFFAOYSA-N |
Product Overview
3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane (CAS 4468-39-7), with molecular formula C21H28O2 and molecular weight 312.21 g/mol. IUPAC: 1-[2-ethyl-3-(4-methoxyphenyl)pentyl]-4-methoxybenzene.
Chemical Property Profile of 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane
Property Insights of 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane
The XLogP value of 6.3 indicates that 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane?
The CAS number of 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane is 4468-39-7.
What is the molecular formula of 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane?
The molecular formula of 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane is C21H28O2.
What is the molecular weight of 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane?
The molecular weight of 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane is 312.21 g/mol.
Where can I buy 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane?
You can request a quote for 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane?
Yes, KEHONG BIO provides custom synthesis services for 3-(p-Methoxybenzyl)-4-(p-methoxyphenyl)hexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.