3-(2-Ethylbut-1-enoxymethyl)pentane
TL;DR: 3-(2-Ethylbut-1-enoxymethyl)pentane (CAS 97029-46-4) is a chemical compound with molecular formula C12H24O and molecular weight 184.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-ethylbut-1-enoxymethyl)pentane
Also Known As: 3-(2-ethylbut-1-enoxymethyl)pentane, (2-ethyl-but-1-enyl)-(2-ethyl-butyl)-ether, 2-ethylbut-1-en-1-yl 2-ethylbutyl ether
| Molecular Formula | C12H24O |
|---|---|
| Molecular Weight | 184.18 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 184.18271 |
| Heavy Atoms | 13 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 97029-46-4 |
|---|---|
| SMILES | CCC(CC)COC=C(CC)CC |
| InChIKey | ORRIDWRRGWHJNU-UHFFFAOYSA-N |
Product Overview
3-(2-Ethylbut-1-enoxymethyl)pentane (CAS 97029-46-4), with molecular formula C12H24O and molecular weight 184.18 g/mol. IUPAC: 3-(2-ethylbut-1-enoxymethyl)pentane.
Chemical Property Profile of 3-(2-Ethylbut-1-enoxymethyl)pentane
Property Insights of 3-(2-Ethylbut-1-enoxymethyl)pentane
The XLogP value of 4.6 indicates that 3-(2-Ethylbut-1-enoxymethyl)pentane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 3-(2-Ethylbut-1-enoxymethyl)pentane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Ethylbut-1-enoxymethyl)pentane has 0 hydrogen bond donor(s) and 1 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-(2-Ethylbut-1-enoxymethyl)pentane?
The CAS number of 3-(2-Ethylbut-1-enoxymethyl)pentane is 97029-46-4.
What is the molecular formula of 3-(2-Ethylbut-1-enoxymethyl)pentane?
The molecular formula of 3-(2-Ethylbut-1-enoxymethyl)pentane is C12H24O.
What is the molecular weight of 3-(2-Ethylbut-1-enoxymethyl)pentane?
The molecular weight of 3-(2-Ethylbut-1-enoxymethyl)pentane is 184.18 g/mol.
Where can I buy 3-(2-Ethylbut-1-enoxymethyl)pentane?
You can request a quote for 3-(2-Ethylbut-1-enoxymethyl)pentane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Ethylbut-1-enoxymethyl)pentane?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Ethylbut-1-enoxymethyl)pentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.