1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane
TL;DR: 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane (CAS 7399-37-3) is a chemical compound with molecular formula C26H30O8 and molecular weight 470.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-acetyloxy-4-[4-(3,4-diacetyloxyphenyl)-2,3-dimethylbutyl]phenyl] acetate
Also Known As: KST-1A7990, 1,4-bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane, (2,3-dimethylbutane-1,4-diyl)dibenzene-4,1,2-triyl tetraacetate, [2-acetyloxy-4-[4-(3,4-diacetyloxyphenyl)-2,3-dimethylbutyl]phenyl] acetate, 3,5-Cyclohexadiene-1,2-diol,3-chloro-6-methyl-,cis-(+-)
| Molecular Formula | C26H30O8 |
|---|---|
| Molecular Weight | 470.19 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 470.19406 |
| Heavy Atoms | 34 |
| Complexity | 660.0 |
Chemical Identifiers
| CAS Number | 7399-37-3 |
|---|---|
| SMILES | CC(CC1=CC(=C(C=C1)OC(=O)C)OC(=O)C)C(C)CC2=CC(=C(C=C2)OC(=O)C)OC(=O)C |
| InChIKey | GWOKMFBQLPXPFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane (CAS 7399-37-3), with molecular formula C26H30O8 and molecular weight 470.19 g/mol. IUPAC: [2-acetyloxy-4-[4-(3,4-diacetyloxyphenyl)-2,3-dimethylbutyl]phenyl] acetate.
Chemical Property Profile of 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane
Property Insights of 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane
The XLogP value of 4.7 indicates that 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane. Following Lipinski's Rule of Five, 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane 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 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane?
The CAS number of 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane is 7399-37-3.
What is the molecular formula of 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane?
The molecular formula of 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane is C26H30O8.
What is the molecular weight of 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane?
The molecular weight of 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane is 470.19 g/mol.
Where can I buy 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane?
You can request a quote for 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(3,4-diacetoxyphenyl)-2,3-dimethylbutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.