过氧化邻苯二甲酰
TL;DR: 过氧化邻苯二甲酰 (CAS 4733-52-2) is a chemical compound with molecular formula C8H4O4 and molecular weight 164.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
过氧化邻苯二甲酰
2,3-benzodioxine-1,4-dione
Also Known As: phthaloyl peroxide, Phthalic peroxide, 2,3-Benzodioxin-1,4-dione, Phthaloylperoxide, 2,3-benzodioxine-1,4-dione
| Molecular Formula | C8H4O4 |
|---|---|
| Molecular Weight | 164.01 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.01096 |
| Heavy Atoms | 12 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 4733-52-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)OOC2=O |
| InChIKey | WMKGMCCZGTXXQU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
过氧化邻苯二甲酰 (CAS 4733-52-2), with molecular formula C8H4O4 and molecular weight 164.01 g/mol. IUPAC: 2,3-benzodioxine-1,4-dione.
Chemical Property Profile of 过氧化邻苯二甲酰
Property Insights of 过氧化邻苯二甲酰
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 过氧化邻苯二甲酰. With a topological polar surface area (TPSA) of 52.6 Ų, 过氧化邻苯二甲酰 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 过氧化邻苯二甲酰 has 0 hydrogen bond donor(s) and 4 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 过氧化邻苯二甲酰?
The CAS number of 过氧化邻苯二甲酰 is 4733-52-2.
What is the molecular formula of 过氧化邻苯二甲酰?
The molecular formula of 过氧化邻苯二甲酰 is C8H4O4.
What is the molecular weight of 过氧化邻苯二甲酰?
The molecular weight of 过氧化邻苯二甲酰 is 164.01 g/mol.
Where can I buy 过氧化邻苯二甲酰?
You can request a quote for 过氧化邻苯二甲酰 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 过氧化邻苯二甲酰?
Yes, KEHONG BIO provides custom synthesis services for 过氧化邻苯二甲酰 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.