Cyclohexane-1,2-dimethanol, diacetate
TL;DR: Cyclohexane-1,2-dimethanol, diacetate (CAS 343250-59-9) is a chemical compound with molecular formula C12H20O4 and molecular weight 228.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(acetyloxymethyl)cyclohexyl]methyl acetate
Also Known As: Cyclohexane-1,2-dimethanol, diacetate, cyclohexane-1,2-diylbis(methylene) diacetate, [2-(acetyloxymethyl)cyclohexyl]methyl acetate, J2.960.409F, (2-[(Acetyloxy)methyl]cyclohexyl)methyl acetate
| Molecular Formula | C12H20O4 |
|---|---|
| Molecular Weight | 228.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 228.13615 |
| Heavy Atoms | 16 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 343250-59-9 |
|---|---|
| SMILES | CC(=O)OCC1CCCCC1COC(=O)C |
| InChIKey | MNUWIWVOUUZHMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexane-1,2-dimethanol, diacetate (CAS 343250-59-9), with molecular formula C12H20O4 and molecular weight 228.14 g/mol. IUPAC: [2-(acetyloxymethyl)cyclohexyl]methyl acetate.
Chemical Property Profile of Cyclohexane-1,2-dimethanol, diacetate
Property Insights of Cyclohexane-1,2-dimethanol, diacetate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexane-1,2-dimethanol, diacetate. With a topological polar surface area (TPSA) of 52.6 Ų, Cyclohexane-1,2-dimethanol, diacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexane-1,2-dimethanol, diacetate has 0 hydrogen bond donor(s) and 4 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 Cyclohexane-1,2-dimethanol, diacetate?
The CAS number of Cyclohexane-1,2-dimethanol, diacetate is 343250-59-9.
What is the molecular formula of Cyclohexane-1,2-dimethanol, diacetate?
The molecular formula of Cyclohexane-1,2-dimethanol, diacetate is C12H20O4.
What is the molecular weight of Cyclohexane-1,2-dimethanol, diacetate?
The molecular weight of Cyclohexane-1,2-dimethanol, diacetate is 228.14 g/mol.
Where can I buy Cyclohexane-1,2-dimethanol, diacetate?
You can request a quote for Cyclohexane-1,2-dimethanol, diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexane-1,2-dimethanol, diacetate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexane-1,2-dimethanol, diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.