4-Cyclohexylhexanoic acid
TL;DR: 4-Cyclohexylhexanoic acid (CAS 6954-26-3) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-cyclohexylhexanoic acid
Also Known As: 4-cyclohexylhexanoic acid, 4-Cyclohexyl-hexansaeure, 4-cyclohexyl-hexanoic acid
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 6954-26-3 |
|---|---|
| SMILES | CCC(CCC(=O)O)C1CCCCC1 |
| InChIKey | YBPBWSMRTHCKFS-UHFFFAOYSA-N |
Product Overview
4-Cyclohexylhexanoic acid (CAS 6954-26-3), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: 4-cyclohexylhexanoic acid.
Chemical Property Profile of 4-Cyclohexylhexanoic acid
Property Insights of 4-Cyclohexylhexanoic acid
The XLogP value of 4.2 indicates that 4-Cyclohexylhexanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4-Cyclohexylhexanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Cyclohexylhexanoic acid has 1 hydrogen bond donor(s) and 2 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-Cyclohexylhexanoic acid?
The CAS number of 4-Cyclohexylhexanoic acid is 6954-26-3.
What is the molecular formula of 4-Cyclohexylhexanoic acid?
The molecular formula of 4-Cyclohexylhexanoic acid is C12H22O2.
What is the molecular weight of 4-Cyclohexylhexanoic acid?
The molecular weight of 4-Cyclohexylhexanoic acid is 198.16 g/mol.
Where can I buy 4-Cyclohexylhexanoic acid?
You can request a quote for 4-Cyclohexylhexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Cyclohexylhexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Cyclohexylhexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.