3,3-Bis(4-acetoxyphenyl)phthalide
TL;DR: 3,3-Bis(4-acetoxyphenyl)phthalide (CAS 6310-38-9) is a chemical compound with molecular formula C24H18O6 and molecular weight 402.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[1-(4-acetyloxyphenyl)-3-oxo-2-benzofuran-1-yl]phenyl] acetate
Also Known As: Laxoral, Diacetoxyphenolphthalein, Phenolphthaleindiacetat, Phenolphthalein, diacetate, 3,3-Bis(4-acetoxyphenyl)phthalide
| Molecular Formula | C24H18O6 |
|---|---|
| Molecular Weight | 402.11 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.11035 |
| Heavy Atoms | 30 |
| Complexity | 621.0 |
Chemical Identifiers
| CAS Number | 6310-38-9 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)OC(=O)C |
| InChIKey | UQJULZIHROYMOK-UHFFFAOYSA-N |
Product Overview
3,3-Bis(4-acetoxyphenyl)phthalide (CAS 6310-38-9), with molecular formula C24H18O6 and molecular weight 402.11 g/mol. IUPAC: [4-[1-(4-acetyloxyphenyl)-3-oxo-2-benzofuran-1-yl]phenyl] acetate.
Chemical Property Profile of 3,3-Bis(4-acetoxyphenyl)phthalide
Property Insights of 3,3-Bis(4-acetoxyphenyl)phthalide
The XLogP value of 3.8 indicates that 3,3-Bis(4-acetoxyphenyl)phthalide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-Bis(4-acetoxyphenyl)phthalide. Following Lipinski's Rule of Five, 3,3-Bis(4-acetoxyphenyl)phthalide 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 3,3-Bis(4-acetoxyphenyl)phthalide?
The CAS number of 3,3-Bis(4-acetoxyphenyl)phthalide is 6310-38-9.
What is the molecular formula of 3,3-Bis(4-acetoxyphenyl)phthalide?
The molecular formula of 3,3-Bis(4-acetoxyphenyl)phthalide is C24H18O6.
What is the molecular weight of 3,3-Bis(4-acetoxyphenyl)phthalide?
The molecular weight of 3,3-Bis(4-acetoxyphenyl)phthalide is 402.11 g/mol.
Where can I buy 3,3-Bis(4-acetoxyphenyl)phthalide?
You can request a quote for 3,3-Bis(4-acetoxyphenyl)phthalide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Bis(4-acetoxyphenyl)phthalide?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Bis(4-acetoxyphenyl)phthalide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.