Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate
TL;DR: Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate (CAS 18142-16-0) is a chemical compound with molecular formula C15H22O8 and molecular weight 330.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate
Also Known As: methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate, methyl 3,5-bis(acetyloxy)-6-(5-oxooxolan-2-yl)hexanoate, 2-Furanhexanoic acid, tetrahydro-.beta.,.delta.-dihydroxy-5-oxo-, methyl ester, diacetate, 2-Furanhexanoic acid, tetrahydro-beta,delta-dihydroxy-5-oxo-, methyl ester, diacetate, Methyl 3,5-bis(acetyloxy)-6-(5-oxotetrahydro-2-furanyl)hexanoate
| Molecular Formula | C15H22O8 |
|---|---|
| Molecular Weight | 330.13 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 330.13147 |
| Heavy Atoms | 23 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 18142-16-0 |
|---|---|
| SMILES | CC(=O)OC(CC1CCC(=O)O1)CC(CC(=O)OC)OC(=O)C |
| InChIKey | PTMAXAHTNABBHZ-UHFFFAOYSA-N |
Product Overview
Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate (CAS 18142-16-0), with molecular formula C15H22O8 and molecular weight 330.13 g/mol. IUPAC: methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate.
Chemical Property Profile of Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate
Property Insights of Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate. Following Lipinski's Rule of Five, Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate has 0 hydrogen bond donor(s) and 8 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 Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate?
The CAS number of Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate is 18142-16-0.
What is the molecular formula of Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate?
The molecular formula of Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate is C15H22O8.
What is the molecular weight of Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate?
The molecular weight of Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate is 330.13 g/mol.
Where can I buy Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate?
You can request a quote for Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3,5-diacetyloxy-6-(5-oxooxolan-2-yl)hexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.