3,3-Diethoxyprop-1-ynylcyclopentane
TL;DR: 3,3-Diethoxyprop-1-ynylcyclopentane (CAS 51149-68-9) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-diethoxyprop-1-ynylcyclopentane
Also Known As: 3,3-diethoxyprop-1-ynylcyclopentane, (3,3-Diethoxyprop-1-yn-1-yl)cyclopentane
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 51149-68-9 |
|---|---|
| SMILES | CCOC(C#CC1CCCC1)OCC |
| InChIKey | XSELNVVDWXTODF-UHFFFAOYSA-N |
Product Overview
3,3-Diethoxyprop-1-ynylcyclopentane (CAS 51149-68-9), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: 3,3-diethoxyprop-1-ynylcyclopentane.
Chemical Property Profile of 3,3-Diethoxyprop-1-ynylcyclopentane
Property Insights of 3,3-Diethoxyprop-1-ynylcyclopentane
The XLogP value of 3.1 indicates that 3,3-Diethoxyprop-1-ynylcyclopentane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 3,3-Diethoxyprop-1-ynylcyclopentane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Diethoxyprop-1-ynylcyclopentane has 0 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 3,3-Diethoxyprop-1-ynylcyclopentane?
The CAS number of 3,3-Diethoxyprop-1-ynylcyclopentane is 51149-68-9.
What is the molecular formula of 3,3-Diethoxyprop-1-ynylcyclopentane?
The molecular formula of 3,3-Diethoxyprop-1-ynylcyclopentane is C12H20O2.
What is the molecular weight of 3,3-Diethoxyprop-1-ynylcyclopentane?
The molecular weight of 3,3-Diethoxyprop-1-ynylcyclopentane is 196.15 g/mol.
Where can I buy 3,3-Diethoxyprop-1-ynylcyclopentane?
You can request a quote for 3,3-Diethoxyprop-1-ynylcyclopentane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Diethoxyprop-1-ynylcyclopentane?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Diethoxyprop-1-ynylcyclopentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.