2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate
TL;DR: 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate (CAS 7402-64-4) is a chemical compound with molecular formula C32H34O7 and molecular weight 530.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[[5-acetyl-2-acetyloxy-3-[(2-acetyloxy-3,5-dimethylphenyl)methyl]phenyl]methyl]-4,6-dimethylphenyl] acetate
Also Known As: 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate, 2-{5-acetyl-2-(acetyloxy)-3-[2-(acetyloxy)-3,5-dimethylbenzyl]benzyl}-4,6-dimethylphenyl acetate, [2-[[5-acetyl-2-acetyloxy-3-[(2-acetyloxy-3,5-dimethylphenyl, [2-[[5-acetyl-2-acetyloxy-3-[(2-acetyloxy-3,5-dimethylphenyl)methyl]phenyl]methyl]-4,6-dimethylphenyl] acetate, {[5-Acetyl-2-(acetyloxy)-1,3-phenylene]bis(methylene)-4,6-dimethyl-2,1-phenylene} diacetate
| Molecular Formula | C32H34O7 |
|---|---|
| Molecular Weight | 530.23 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 96.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 530.23047 |
| Heavy Atoms | 39 |
| Complexity | 828.0 |
Chemical Identifiers
| CAS Number | 7402-64-4 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)CC2=CC(=CC(=C2OC(=O)C)CC3=CC(=CC(=C3OC(=O)C)C)C)C(=O)C)OC(=O)C)C |
| InChIKey | WMZWMPKLOSJSPO-UHFFFAOYSA-N |
Product Overview
2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate (CAS 7402-64-4), with molecular formula C32H34O7 and molecular weight 530.23 g/mol. IUPAC: [2-[[5-acetyl-2-acetyloxy-3-[(2-acetyloxy-3,5-dimethylphenyl)methyl]phenyl]methyl]-4,6-dimethylphenyl] acetate.
Chemical Property Profile of 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate
Property Insights of 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate
The XLogP value of 6.2 indicates that 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate. Following Lipinski's Rule of Five, 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate?
The CAS number of 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate is 7402-64-4.
What is the molecular formula of 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate?
The molecular formula of 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate is C32H34O7.
What is the molecular weight of 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate?
The molecular weight of 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate is 530.23 g/mol.
Where can I buy 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate?
You can request a quote for 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-Acetoxy-3-(2-acetoxy-3,5-dimethylbenzyl)-5-acetylbenzyl]-4,6-dimethylphenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.