乙苯氢过氧化物
TL;DR: 乙苯氢过氧化物 (CAS 3071-32-7) is a chemical compound with molecular formula C8H10O2 and molecular weight 138.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙苯氢过氧化物
1-hydroperoxyethylbenzene
Also Known As: 1-Phenylethyl hydroperoxide, Ethylbenzene hydroperoxide, 1-hydroperoxyethylbenzene, EBHP, Hydroperoxide, 1-phenylethyl
| Molecular Formula | C8H10O2 |
|---|---|
| Molecular Weight | 138.07 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 138.06808 |
| Heavy Atoms | 10 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 3071-32-7 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)OO |
| InChIKey | GQNOPVSQPBUJKQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙苯氢过氧化物 (CAS 3071-32-7), with molecular formula C8H10O2 and molecular weight 138.07 g/mol. IUPAC: 1-hydroperoxyethylbenzene.
Chemical Property Profile of 乙苯氢过氧化物
Property Insights of 乙苯氢过氧化物
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 乙苯氢过氧化物. With a topological polar surface area (TPSA) of 29.5 Ų, 乙苯氢过氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙苯氢过氧化物 has 1 hydrogen bond donor(s) and 2 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 乙苯氢过氧化物?
The CAS number of 乙苯氢过氧化物 is 3071-32-7.
What is the molecular formula of 乙苯氢过氧化物?
The molecular formula of 乙苯氢过氧化物 is C8H10O2.
What is the molecular weight of 乙苯氢过氧化物?
The molecular weight of 乙苯氢过氧化物 is 138.07 g/mol.
Where can I buy 乙苯氢过氧化物?
You can request a quote for 乙苯氢过氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙苯氢过氧化物?
Yes, KEHONG BIO provides custom synthesis services for 乙苯氢过氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.