3-Cyclohexenyl hydroperoxide
TL;DR: 3-Cyclohexenyl hydroperoxide (CAS 4096-33-7) is a chemical compound with molecular formula C6H10O2 and molecular weight 114.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroperoxycyclohexene
Also Known As: 3-Cyclohexenyl hydroperoxide, 1-Hydroperoxycyclo-3-hexene, 3-cyclohexenylhydroperoxide, 1-Hydroperoxycyclohex-3-ene, 4-hydroperoxycyclohexene
| Molecular Formula | C6H10O2 |
|---|---|
| Molecular Weight | 114.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 114.06808 |
| Heavy Atoms | 8 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 4096-33-7 |
|---|---|
| SMILES | C1CC(CC=C1)OO |
| InChIKey | WORNONSVRBSMMN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Cyclohexenyl hydroperoxide (CAS 4096-33-7), with molecular formula C6H10O2 and molecular weight 114.07 g/mol. IUPAC: 4-hydroperoxycyclohexene.
Chemical Property Profile of 3-Cyclohexenyl hydroperoxide
Property Insights of 3-Cyclohexenyl hydroperoxide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Cyclohexenyl hydroperoxide. With a topological polar surface area (TPSA) of 29.5 Ų, 3-Cyclohexenyl hydroperoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Cyclohexenyl hydroperoxide 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 3-Cyclohexenyl hydroperoxide?
The CAS number of 3-Cyclohexenyl hydroperoxide is 4096-33-7.
What is the molecular formula of 3-Cyclohexenyl hydroperoxide?
The molecular formula of 3-Cyclohexenyl hydroperoxide is C6H10O2.
What is the molecular weight of 3-Cyclohexenyl hydroperoxide?
The molecular weight of 3-Cyclohexenyl hydroperoxide is 114.07 g/mol.
Where can I buy 3-Cyclohexenyl hydroperoxide?
You can request a quote for 3-Cyclohexenyl hydroperoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Cyclohexenyl hydroperoxide?
Yes, KEHONG BIO provides custom synthesis services for 3-Cyclohexenyl hydroperoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.