1,2-Cyclohexanediol, monoacetate
TL;DR: 1,2-Cyclohexanediol, monoacetate (CAS 22241-34-5) is a chemical compound with molecular formula C8H14O3 and molecular weight 158.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxycyclohexyl) acetate
Also Known As: 2-Acetoxycyclohexanol, 2-Hydroxycyclohexyl acetate, 2-acetoxycyclohexan-1-ol, (2-hydroxycyclohexyl) acetate, 2-Hydroxycyclohexyl acetate #
| Molecular Formula | C8H14O3 |
|---|---|
| Molecular Weight | 158.09 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.0943 |
| Heavy Atoms | 11 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 22241-34-5 |
|---|---|
| SMILES | CC(=O)OC1CCCCC1O |
| InChIKey | GCPZLJNKHNJVGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Cyclohexanediol, monoacetate (CAS 22241-34-5), with molecular formula C8H14O3 and molecular weight 158.09 g/mol. IUPAC: (2-hydroxycyclohexyl) acetate.
Chemical Property Profile of 1,2-Cyclohexanediol, monoacetate
Property Insights of 1,2-Cyclohexanediol, monoacetate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Cyclohexanediol, monoacetate. With a topological polar surface area (TPSA) of 46.5 Ų, 1,2-Cyclohexanediol, monoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Cyclohexanediol, monoacetate has 1 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 1,2-Cyclohexanediol, monoacetate?
The CAS number of 1,2-Cyclohexanediol, monoacetate is 22241-34-5.
What is the molecular formula of 1,2-Cyclohexanediol, monoacetate?
The molecular formula of 1,2-Cyclohexanediol, monoacetate is C8H14O3.
What is the molecular weight of 1,2-Cyclohexanediol, monoacetate?
The molecular weight of 1,2-Cyclohexanediol, monoacetate is 158.09 g/mol.
Where can I buy 1,2-Cyclohexanediol, monoacetate?
You can request a quote for 1,2-Cyclohexanediol, monoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Cyclohexanediol, monoacetate?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Cyclohexanediol, monoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.