1,1'-Bi(cyclohexyl)-2-yl butanoate
TL;DR: 1,1'-Bi(cyclohexyl)-2-yl butanoate (CAS 11055-01-9) is a chemical compound with molecular formula C16H28O2 and molecular weight 252.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-cyclohexylcyclohexyl) butanoate
Also Known As: 1,1'-bi(cyclohexyl)-2-yl butanoate, (2-cyclohexylcyclohexyl) butanoate, KST-1A9826, [1,1'-Bi(cyclohexan)]-2-yl butanoate, Butanoic acid,[1,1'-bicyclohexyl]-2-yl ester
| Molecular Formula | C16H28O2 |
|---|---|
| Molecular Weight | 252.21 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.20892 |
| Heavy Atoms | 18 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 11055-01-9 |
|---|---|
| SMILES | CCCC(=O)OC1CCCCC1C2CCCCC2 |
| InChIKey | NUDKHOLOVCXNHR-UHFFFAOYSA-N |
Product Overview
1,1'-Bi(cyclohexyl)-2-yl butanoate (CAS 11055-01-9), with molecular formula C16H28O2 and molecular weight 252.21 g/mol. IUPAC: (2-cyclohexylcyclohexyl) butanoate.
Chemical Property Profile of 1,1'-Bi(cyclohexyl)-2-yl butanoate
Property Insights of 1,1'-Bi(cyclohexyl)-2-yl butanoate
The XLogP value of 5.4 indicates that 1,1'-Bi(cyclohexyl)-2-yl butanoate 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)-2-yl butanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-Bi(cyclohexyl)-2-yl butanoate 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)-2-yl butanoate?
The CAS number of 1,1'-Bi(cyclohexyl)-2-yl butanoate is 11055-01-9.
What is the molecular formula of 1,1'-Bi(cyclohexyl)-2-yl butanoate?
The molecular formula of 1,1'-Bi(cyclohexyl)-2-yl butanoate is C16H28O2.
What is the molecular weight of 1,1'-Bi(cyclohexyl)-2-yl butanoate?
The molecular weight of 1,1'-Bi(cyclohexyl)-2-yl butanoate is 252.21 g/mol.
Where can I buy 1,1'-Bi(cyclohexyl)-2-yl butanoate?
You can request a quote for 1,1'-Bi(cyclohexyl)-2-yl butanoate 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)-2-yl butanoate?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Bi(cyclohexyl)-2-yl butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.