1,1'-Bi(cyclohexyl)-4-yl pentanoate
TL;DR: 1,1'-Bi(cyclohexyl)-4-yl pentanoate (CAS 115087-92-8) is a chemical compound with molecular formula C17H30O2 and molecular weight 266.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-cyclohexylcyclohexyl) pentanoate
Also Known As: 1,1'-bi(cyclohexyl)-4-yl pentanoate, (4-cyclohexylcyclohexyl) pentanoate, KST-1A9935, [1,1'-Bi(cyclohexan)]-4-yl pentanoate, Pentanoic acid,[1,1'-bicyclohexyl]-4-yl ester
| Molecular Formula | C17H30O2 |
|---|---|
| Molecular Weight | 266.22 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 266.22458 |
| Heavy Atoms | 19 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 115087-92-8 |
|---|---|
| SMILES | CCCCC(=O)OC1CCC(CC1)C2CCCCC2 |
| InChIKey | RRDANBZVZRSKOX-UHFFFAOYSA-N |
Product Overview
1,1'-Bi(cyclohexyl)-4-yl pentanoate (CAS 115087-92-8), with molecular formula C17H30O2 and molecular weight 266.22 g/mol. IUPAC: (4-cyclohexylcyclohexyl) pentanoate.
Chemical Property Profile of 1,1'-Bi(cyclohexyl)-4-yl pentanoate
Property Insights of 1,1'-Bi(cyclohexyl)-4-yl pentanoate
The XLogP value of 5.8 indicates that 1,1'-Bi(cyclohexyl)-4-yl pentanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1,1'-Bi(cyclohexyl)-4-yl pentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-Bi(cyclohexyl)-4-yl pentanoate 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 1,1'-Bi(cyclohexyl)-4-yl pentanoate?
The CAS number of 1,1'-Bi(cyclohexyl)-4-yl pentanoate is 115087-92-8.
What is the molecular formula of 1,1'-Bi(cyclohexyl)-4-yl pentanoate?
The molecular formula of 1,1'-Bi(cyclohexyl)-4-yl pentanoate is C17H30O2.
What is the molecular weight of 1,1'-Bi(cyclohexyl)-4-yl pentanoate?
The molecular weight of 1,1'-Bi(cyclohexyl)-4-yl pentanoate is 266.22 g/mol.
Where can I buy 1,1'-Bi(cyclohexyl)-4-yl pentanoate?
You can request a quote for 1,1'-Bi(cyclohexyl)-4-yl pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Bi(cyclohexyl)-4-yl pentanoate?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Bi(cyclohexyl)-4-yl pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.