Adamantane, 2-hydroperoxy-2-ethenyl-
TL;DR: Adamantane, 2-hydroperoxy-2-ethenyl- (CAS 3529-04-2) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethenyl-2-hydroperoxyadamantane
Also Known As: 2-ethenyl-2-hydroperoxyadamantane, Adamantane, 2-hydroperoxy-2-ethenyl-, 2-Vinyl-2-adamantyl hydroperoxide #
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 3529-04-2 |
|---|---|
| SMILES | C=CC1(C2CC3CC(C2)CC1C3)OO |
| InChIKey | WAAXTWAYFCQZNV-UHFFFAOYSA-N |
Product Overview
Adamantane, 2-hydroperoxy-2-ethenyl- (CAS 3529-04-2), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: 2-ethenyl-2-hydroperoxyadamantane.
Chemical Property Profile of Adamantane, 2-hydroperoxy-2-ethenyl-
Property Insights of Adamantane, 2-hydroperoxy-2-ethenyl-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Adamantane, 2-hydroperoxy-2-ethenyl-. With a topological polar surface area (TPSA) of 29.5 Ų, Adamantane, 2-hydroperoxy-2-ethenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Adamantane, 2-hydroperoxy-2-ethenyl- 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 Adamantane, 2-hydroperoxy-2-ethenyl-?
The CAS number of Adamantane, 2-hydroperoxy-2-ethenyl- is 3529-04-2.
What is the molecular formula of Adamantane, 2-hydroperoxy-2-ethenyl-?
The molecular formula of Adamantane, 2-hydroperoxy-2-ethenyl- is C12H18O2.
What is the molecular weight of Adamantane, 2-hydroperoxy-2-ethenyl-?
The molecular weight of Adamantane, 2-hydroperoxy-2-ethenyl- is 194.13 g/mol.
Where can I buy Adamantane, 2-hydroperoxy-2-ethenyl-?
You can request a quote for Adamantane, 2-hydroperoxy-2-ethenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adamantane, 2-hydroperoxy-2-ethenyl-?
Yes, KEHONG BIO provides custom synthesis services for Adamantane, 2-hydroperoxy-2-ethenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.