Hydroperoxide, heptyl
TL;DR: Hydroperoxide, heptyl (CAS 764-81-8) is a chemical compound with molecular formula CCCCCCCOO and molecular weight 132.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroperoxyheptane
Also Known As: Heptyl hydroperoxide, Hydroperoxide, heptyl, 1-Hydroperoxyheptane, dioxanonane, heptane-1-peroxol
| Molecular Formula | CCCCCCCOO |
|---|---|
| Molecular Weight | 132.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 132.11504 |
| Heavy Atoms | 9 |
| Complexity | 46.0 |
Chemical Identifiers
| CAS Number | 764-81-8 |
|---|---|
| SMILES | CCCCCCCOO |
| InChIKey | XIOGAMSXYSPUSI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hydroperoxide, heptyl (CAS 764-81-8), with molecular formula CCCCCCCOO and molecular weight 132.12 g/mol. IUPAC: 1-hydroperoxyheptane.
Chemical Property Profile of Hydroperoxide, heptyl
Property Insights of Hydroperoxide, heptyl
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroperoxide, heptyl. With a topological polar surface area (TPSA) of 29.5 Ų, Hydroperoxide, heptyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydroperoxide, heptyl 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 Hydroperoxide, heptyl?
The CAS number of Hydroperoxide, heptyl is 764-81-8.
What is the molecular formula of Hydroperoxide, heptyl?
The molecular formula of Hydroperoxide, heptyl is CCCCCCCOO.
What is the molecular weight of Hydroperoxide, heptyl?
The molecular weight of Hydroperoxide, heptyl is 132.12 g/mol.
Where can I buy Hydroperoxide, heptyl?
You can request a quote for Hydroperoxide, heptyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroperoxide, heptyl?
Yes, KEHONG BIO provides custom synthesis services for Hydroperoxide, heptyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.