Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester
TL;DR: Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester (CAS 68366-65-4) is a chemical compound with molecular formula C14H26O2 and molecular weight 226.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-2-propan-2-ylcyclohexyl) 2-methylpropanoate
Also Known As: l-Menthyl isobutyrate, (-)-Menthyl isobutyrate, isomenthyl isobutyrate, isobutyric acid menthyl ester, (5-methyl-2-propan-2-ylcyclohexyl) 2-methylpropanoate
| Molecular Formula | C14H26O2 |
|---|---|
| Molecular Weight | 226.19 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 226.19328 |
| Heavy Atoms | 16 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 68366-65-4 |
|---|---|
| SMILES | CC1CCC(C(C1)OC(=O)C(C)C)C(C)C |
| InChIKey | CSZKNSMAMITXAD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester (CAS 68366-65-4), with molecular formula C14H26O2 and molecular weight 226.19 g/mol. IUPAC: (5-methyl-2-propan-2-ylcyclohexyl) 2-methylpropanoate.
Chemical Property Profile of Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester
Property Insights of Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester
The XLogP value of 4.6 indicates that Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)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, Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)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
Frequently Asked Questions
What is the CAS number of Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester?
The CAS number of Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester is 68366-65-4.
What is the molecular formula of Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester?
The molecular formula of Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester is C14H26O2.
What is the molecular weight of Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester?
The molecular weight of Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester is 226.19 g/mol.
Where can I buy Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester?
You can request a quote for Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.