1-(4-Methoxyphenyl)adamantane
TL;DR: 1-(4-Methoxyphenyl)adamantane (CAS 726-94-3) is a chemical compound with molecular formula C17H22O and molecular weight 242.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)adamantane
Also Known As: 1-(4-methoxyphenyl)adamantane, Adapalene Impurity 12, Adapalene Impurity 21, TimTec1_001470, 1-adamantanyl-4-methoxybenzene
| Molecular Formula | C17H22O |
|---|---|
| Molecular Weight | 242.17 g/mol |
| LogP | 4.163 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.16707 |
| Heavy Atoms | 18 |
| Complexity | 409.89862 |
Chemical Identifiers
| CAS Number | 726-94-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3 |
Product Overview
1-(4-Methoxyphenyl)adamantane (CAS 726-94-3), with molecular formula C17H22O and molecular weight 242.17 g/mol. IUPAC: 1-(4-methoxyphenyl)adamantane.
Chemical Property Profile of 1-(4-Methoxyphenyl)adamantane
Property Insights of 1-(4-Methoxyphenyl)adamantane
The XLogP value of 4.163 indicates that 1-(4-Methoxyphenyl)adamantane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 1-(4-Methoxyphenyl)adamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methoxyphenyl)adamantane has 0 hydrogen bond donor(s) and 1 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-(4-Methoxyphenyl)adamantane?
The CAS number of 1-(4-Methoxyphenyl)adamantane is 726-94-3.
What is the molecular formula of 1-(4-Methoxyphenyl)adamantane?
The molecular formula of 1-(4-Methoxyphenyl)adamantane is C17H22O.
What is the molecular weight of 1-(4-Methoxyphenyl)adamantane?
The molecular weight of 1-(4-Methoxyphenyl)adamantane is 242.17 g/mol.
Where can I buy 1-(4-Methoxyphenyl)adamantane?
You can request a quote for 1-(4-Methoxyphenyl)adamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methoxyphenyl)adamantane?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methoxyphenyl)adamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.