Pentanoic acid, cyclohexyl ester
TL;DR: Pentanoic acid, cyclohexyl ester (CAS 1551-43-5) is a chemical compound with molecular formula C11H20O2 and molecular weight 184.14633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cyclohexyl pentanoate
Also Known As: Cyclohexyl valerate, Cyclohexyl pentanoate, Cyclohexylvalerate, Cyclohexyl n-valerate, 1-Cyclohexyl pentanoate
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H20O2 |
| Molecular Weight | 184.14633 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 184.14633 Da |
| Heavy Atoms | 13 |
| Complexity | 148.0 |
| Boiling Point | 231.00 to 233.00 °C. @ 760.00 mm Hg |
| SMILES | CCCCC(=O)OC1CCCCC1 |
| InChIKey | YLCHTSSXNSNXSW-UHFFFAOYSA-N |
Chemical Property Profile of Pentanoic acid, cyclohexyl ester
Property Insights of Pentanoic acid, cyclohexyl ester
The XLogP value of 3.3 indicates that Pentanoic acid, cyclohexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Pentanoic acid, cyclohexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentanoic acid, cyclohexyl ester has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Pentanoic acid, cyclohexyl ester?
The CAS number of Pentanoic acid, cyclohexyl ester is 1551-43-5.
What is the molecular formula of Pentanoic acid, cyclohexyl ester?
The molecular formula of Pentanoic acid, cyclohexyl ester is C11H20O2.
What is the molecular weight of Pentanoic acid, cyclohexyl ester?
The molecular weight of Pentanoic acid, cyclohexyl ester is 184.14633 g/mol.
Where can I buy Pentanoic acid, cyclohexyl ester?
You can request a quote for Pentanoic acid, cyclohexyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pentanoic acid, cyclohexyl ester?
Yes, CoreyChem provides custom synthesis services for Pentanoic acid, cyclohexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.