4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene
TL;DR: 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene (CAS 53922-67-1) is a chemical compound with molecular formula C9H14O and molecular weight 138.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-3,5-dimethylcyclohexa-1,4-diene
Also Known As: 1-methoxy-3,5-dimethylcyclohexa-1,4-diene, 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene, 1-Methoxy-3,5-dimethyl-1,4-cyclohexadiene, 1,4-Cyclohexadiene,1-methoxy-3,5-dimethyl-
| Molecular Formula | C9H14O |
|---|---|
| Molecular Weight | 138.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 138.10446 |
| Heavy Atoms | 10 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 53922-67-1 |
|---|---|
| SMILES | CC1C=C(CC(=C1)OC)C |
| InChIKey | YRQQMIOKCMMHGW-UHFFFAOYSA-N |
Product Overview
4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene (CAS 53922-67-1), with molecular formula C9H14O and molecular weight 138.10 g/mol. IUPAC: 1-methoxy-3,5-dimethylcyclohexa-1,4-diene.
Chemical Property Profile of 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene
Property Insights of 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene. With a topological polar surface area (TPSA) of 9.2 Ų, 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene 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 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene?
The CAS number of 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene is 53922-67-1.
What is the molecular formula of 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene?
The molecular formula of 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene is C9H14O.
What is the molecular weight of 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene?
The molecular weight of 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene is 138.10 g/mol.
Where can I buy 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene?
You can request a quote for 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-2,6-dimethyl-1,4-cyclohexadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.