[4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate
TL;DR: [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate (CAS 7464-32-6) is a chemical compound with molecular formula C15H18O6 and molecular weight 294.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(5-methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate
Also Known As: [4-(5-methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate|4-(5-METHYL-1,3-DIOXOLAN-4-YL)-1,3-DIOXAN-5-YL BENZOATE
| Molecular Formula | C15H18O6 |
|---|---|
| Molecular Weight | 294.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.11035 |
| Heavy Atoms | 21 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 7464-32-6 |
|---|---|
| SMILES | CC1C(OCO1)C2C(COCO2)OC(=O)C3=CC=CC=C3 |
| InChIKey | OBMAFXYXYHBWLG-UHFFFAOYSA-N |
Product Overview
[4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate (CAS 7464-32-6), with molecular formula C15H18O6 and molecular weight 294.11 g/mol. IUPAC: [4-(5-methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate.
Chemical Property Profile of [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate
Property Insights of [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate. Following Lipinski's Rule of Five, [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate has 0 hydrogen bond donor(s) and 6 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 [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate?
The CAS number of [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate is 7464-32-6.
What is the molecular formula of [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate?
The molecular formula of [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate is C15H18O6.
What is the molecular weight of [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate?
The molecular weight of [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate is 294.11 g/mol.
Where can I buy [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate?
You can request a quote for [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate?
Yes, KEHONG BIO provides custom synthesis services for [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.