(2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane
TL;DR: (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane (CAS 77026-84-7) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane
Also Known As: 5-Isopropenyl-2-methylene-cyclohexyl-hydroperoxide, J1.736.819B, (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane, (2S,4R)-p-Mentha-[1(7),8]-diene 2-hydroperoxide, (-)-(2R,4S)-p-Mentha-1(7),8-dien-2-hydroperoxide
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 77026-84-7 |
|---|---|
| SMILES | CC(=C)[C@H]1CCC(=C)[C@H](C1)OO |
| InChIKey | CSOZFPOODGAASP-UWVGGRQHSA-N |
Product Overview
(2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane (CAS 77026-84-7), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: trans-(2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane.
Chemical Property Profile of (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane
Property Insights of (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane. With a topological polar surface area (TPSA) of 29.5 Ų, (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane 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 (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane?
The CAS number of (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane is 77026-84-7.
What is the molecular formula of (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane?
The molecular formula of (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane is C10H16O2.
What is the molecular weight of (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane?
The molecular weight of (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane is 168.12 g/mol.
Where can I buy (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane?
You can request a quote for (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane?
Yes, KEHONG BIO provides custom synthesis services for (2S,4S)-2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.