Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate
TL;DR: Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate (CAS 63715-96-8) is a chemical compound with molecular formula C16H28O5 and molecular weight 300.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-acetyloxy-3-(3,3,5-trimethylcyclohexyl)oxypropyl] acetate
Also Known As: 3-[oxy]-1,2-propanediol1,2-diacetate, 1-(3,5,5-Trimethylcyclohexyl)ether-2,3-diacetate glycerol, 3-[ oxy]-1,2-propanediol1,2-diacetate, 1-(3,5,5-Trimethylcyclohexyl)glycerol ether-2,3-diacetate, Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate
| Molecular Formula | C16H28O5 |
|---|---|
| Molecular Weight | 300.19 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 300.19366 |
| Heavy Atoms | 21 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 63715-96-8 |
|---|---|
| SMILES | CC1CC(CC(C1)(C)C)OCC(COC(=O)C)OC(=O)C |
| InChIKey | SRXIDOKQJSNPIT-UHFFFAOYSA-N |
Product Overview
Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate (CAS 63715-96-8), with molecular formula C16H28O5 and molecular weight 300.19 g/mol. IUPAC: [2-acetyloxy-3-(3,3,5-trimethylcyclohexyl)oxypropyl] acetate.
Chemical Property Profile of Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate
Property Insights of Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate
The XLogP value of 3.0 indicates that Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate. Following Lipinski's Rule of Five, Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate has 0 hydrogen bond donor(s) and 5 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 Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate?
The CAS number of Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate is 63715-96-8.
What is the molecular formula of Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate?
The molecular formula of Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate is C16H28O5.
What is the molecular weight of Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate?
The molecular weight of Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate is 300.19 g/mol.
Where can I buy Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate?
You can request a quote for Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate?
Yes, KEHONG BIO provides custom synthesis services for Propanetriol, 1-(3,5,5-trimethylcyclohexyl)ether, 2,3-diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.