p-Xylenolphthalein
TL;DR: p-Xylenolphthalein (CAS 1246759-68-1) is a chemical compound with molecular formula C24H22O4 and molecular weight 374.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-bis(4-hydroxy-2,5-dimethylphenyl)-2-benzofuran-1-one
Also Known As: p-Xylenolphthalein, 3,3-Bis(4-hydroxy-2,5-dimethylphenyl)isobenzofuran-1(3H)-one, xylenolphthalein, P-xylenolphthaleine, 3,3-Bis(4-hydroxy-2,5-xylyl)phthalide
| Molecular Formula | C24H22O4 |
|---|---|
| Molecular Weight | 374.15 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 374.1518 |
| Heavy Atoms | 28 |
| Complexity | 559.0 |
Chemical Identifiers
| CAS Number | 1246759-68-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1O)C)C2(C3=CC=CC=C3C(=O)O2)C4=C(C=C(C(=C4)C)O)C |
| InChIKey | PXCIPOXPHMTCIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Xylenolphthalein (CAS 1246759-68-1), with molecular formula C24H22O4 and molecular weight 374.15 g/mol. IUPAC: 3,3-bis(4-hydroxy-2,5-dimethylphenyl)-2-benzofuran-1-one.
Chemical Property Profile of p-Xylenolphthalein
Property Insights of p-Xylenolphthalein
The XLogP value of 5.3 indicates that p-Xylenolphthalein is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for p-Xylenolphthalein. Following Lipinski's Rule of Five, p-Xylenolphthalein has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of p-Xylenolphthalein?
The CAS number of p-Xylenolphthalein is 1246759-68-1.
What is the molecular formula of p-Xylenolphthalein?
The molecular formula of p-Xylenolphthalein is C24H22O4.
What is the molecular weight of p-Xylenolphthalein?
The molecular weight of p-Xylenolphthalein is 374.15 g/mol.
Where can I buy p-Xylenolphthalein?
You can request a quote for p-Xylenolphthalein directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Xylenolphthalein?
Yes, KEHONG BIO provides custom synthesis services for p-Xylenolphthalein and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.