Pentane, 2-ethoxy-
TL;DR: Pentane, 2-ethoxy- (CAS 1817-89-6) is a chemical compound with molecular formula C7H16O and molecular weight 116.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxypentane
Also Known As: 2-Ethoxypentane, Pentane, 2-ethoxy-, sec-Amyl ethyl ether, Propylather, Ethyl 1-methylbutyl ether
| Molecular Formula | C7H16O |
|---|---|
| Molecular Weight | 116.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 116.12012 |
| Heavy Atoms | 8 |
| Complexity | 43.0 |
Chemical Identifiers
| CAS Number | 1817-89-6 |
|---|---|
| SMILES | CCCC(C)OCC |
| InChIKey | XFKPOLRDQWCGPV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentane, 2-ethoxy- (CAS 1817-89-6), with molecular formula C7H16O and molecular weight 116.12 g/mol. IUPAC: 2-ethoxypentane.
Chemical Property Profile of Pentane, 2-ethoxy-
Property Insights of Pentane, 2-ethoxy-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentane, 2-ethoxy-. With a topological polar surface area (TPSA) of 9.2 Ų, Pentane, 2-ethoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentane, 2-ethoxy- 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 Pentane, 2-ethoxy-?
The CAS number of Pentane, 2-ethoxy- is 1817-89-6.
What is the molecular formula of Pentane, 2-ethoxy-?
The molecular formula of Pentane, 2-ethoxy- is C7H16O.
What is the molecular weight of Pentane, 2-ethoxy-?
The molecular weight of Pentane, 2-ethoxy- is 116.12 g/mol.
Where can I buy Pentane, 2-ethoxy-?
You can request a quote for Pentane, 2-ethoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentane, 2-ethoxy-?
Yes, KEHONG BIO provides custom synthesis services for Pentane, 2-ethoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.