过氧化苯甲酰
TL;DR: 过氧化苯甲酰 (CAS 94-36-0) is a chemical compound with molecular formula C14H10O4 and molecular weight 242.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
过氧化苯甲酰
benzoyl benzenecarboperoxoate
Also Known As: BENZOYL PEROXIDE, Dibenzoyl peroxide, Benzoyl superoxide, Benzoperoxide, Lucidol
| Molecular Formula | C14H10O4 |
|---|---|
| Molecular Weight | 242.06 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.0579 |
| Heavy Atoms | 18 |
| Complexity | 258.0 |
| Melting Point | 217 to 105.0 °C (decomposes) |
| Boiling Point | Decomposes explosively |
| Density | 1.334 at 15.0 °C |
| Solubility | less than 1 mg/mL at 79 °F (NTP, 1992) |
| Flash Point | 80.0 °C |
| Vapor Pressure | less than 0.1 mmHg at 20.0 °C |
| Refractive Index | 1.543 |
Chemical Identifiers
| CAS Number | 94-36-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2 |
| InChIKey | OMPJBNCRMGITSC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
过氧化苯甲酰 (CAS 94-36-0), with molecular formula C14H10O4 and molecular weight 242.06 g/mol. IUPAC: benzoyl benzenecarboperoxoate.
Chemical Property Profile of 过氧化苯甲酰
Property Insights of 过氧化苯甲酰
The XLogP value of 3.5 indicates that 过氧化苯甲酰 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 过氧化苯甲酰 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 过氧化苯甲酰 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 过氧化苯甲酰?
The CAS number of 过氧化苯甲酰 is 94-36-0.
What is the molecular formula of 过氧化苯甲酰?
The molecular formula of 过氧化苯甲酰 is C14H10O4.
What is the molecular weight of 过氧化苯甲酰?
The molecular weight of 过氧化苯甲酰 is 242.06 g/mol.
Where can I buy 过氧化苯甲酰?
You can request a quote for 过氧化苯甲酰 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 过氧化苯甲酰?
Yes, KEHONG BIO provides custom synthesis services for 过氧化苯甲酰 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.