Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate
TL;DR: Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate (CAS 67845-58-3) is a chemical compound with molecular formula C12H22O3 and molecular weight 214.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methoxy-4-propylcyclohexyl) acetate
Also Known As: Octahydroeugenyl acetate, 2-Methoxy-4-propylcyclohexyl acetate, Cyclohexanol, 2-methoxy-4-propyl-, acetate, Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate, 2-Methoxy-4-propylcyclohexanol acetate
| Molecular Formula | C12H22O3 |
|---|---|
| Molecular Weight | 214.16 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 214.15689 |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 67845-58-3 |
|---|---|
| SMILES | CCCC1CCC(C(C1)OC)OC(=O)C |
| InChIKey | DCHIIKAIQRAGHB-UHFFFAOYSA-N |
Product Overview
Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate (CAS 67845-58-3), with molecular formula C12H22O3 and molecular weight 214.16 g/mol. IUPAC: (2-methoxy-4-propylcyclohexyl) acetate.
Chemical Property Profile of Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate
Property Insights of Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate. With a topological polar surface area (TPSA) of 35.5 Ų, Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate has 0 hydrogen bond donor(s) and 3 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 Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate?
The CAS number of Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate is 67845-58-3.
What is the molecular formula of Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate?
The molecular formula of Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate is C12H22O3.
What is the molecular weight of Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate?
The molecular weight of Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate is 214.16 g/mol.
Where can I buy Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate?
You can request a quote for Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanol, 2-methoxy-4-propyl-, 1-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.