Bis(4-methylcyclohexyl) adipate
TL;DR: Bis(4-methylcyclohexyl) adipate (CAS 41544-42-7) is a chemical compound with molecular formula C20H34O4 and molecular weight 338.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(4-methylcyclohexyl) hexanedioate
Also Known As: Bis(4-methylcyclohexyl) adipate, bis(4-methylcyclohexyl) hexanedioate, EINECS 255-435-0, bis-(4-Methylcyclohexyl) adipate, hexanedioic acid bis-(4-methyl-cyclohexyl) ester
| Molecular Formula | C20H34O4 |
|---|---|
| Molecular Weight | 338.25 g/mol |
| LogP | 4.7906 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 338.2457 |
| Heavy Atoms | 24 |
| Complexity | 352.44302 |
Chemical Identifiers
| CAS Number | 41544-42-7 |
|---|---|
| SMILES | CC1CCC(CC1)OC(=O)CCCCC(=O)OC2CCC(CC2)C |
Product Overview
Bis(4-methylcyclohexyl) adipate (CAS 41544-42-7), with molecular formula C20H34O4 and molecular weight 338.25 g/mol. IUPAC: bis(4-methylcyclohexyl) hexanedioate.
Chemical Property Profile of Bis(4-methylcyclohexyl) adipate
Property Insights of Bis(4-methylcyclohexyl) adipate
The XLogP value of 4.7906 indicates that Bis(4-methylcyclohexyl) adipate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Bis(4-methylcyclohexyl) adipate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(4-methylcyclohexyl) adipate has 0 hydrogen bond donor(s) and 4 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 Bis(4-methylcyclohexyl) adipate?
The CAS number of Bis(4-methylcyclohexyl) adipate is 41544-42-7.
What is the molecular formula of Bis(4-methylcyclohexyl) adipate?
The molecular formula of Bis(4-methylcyclohexyl) adipate is C20H34O4.
What is the molecular weight of Bis(4-methylcyclohexyl) adipate?
The molecular weight of Bis(4-methylcyclohexyl) adipate is 338.25 g/mol.
Where can I buy Bis(4-methylcyclohexyl) adipate?
You can request a quote for Bis(4-methylcyclohexyl) adipate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(4-methylcyclohexyl) adipate?
Yes, KEHONG BIO provides custom synthesis services for Bis(4-methylcyclohexyl) adipate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.