Hexyl methyl ether
TL;DR: Hexyl methyl ether (CAS 4747-07-3) 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.
1-methoxyhexane
Also Known As: 1-Methoxyhexane, Hexyl methyl ether, Methyl hexyl ether, Hexane, 1-methoxy-, N-HEXYLMETHYLETHER
| Molecular Formula | C7H16O |
|---|---|
| Molecular Weight | 116.12 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 116.12012 |
| Heavy Atoms | 8 |
| Complexity | 35.0 |
| Density | 0.765-0.775 |
| Solubility | Practically insoluble to insoluble in water |
| Refractive Index | 1.393-1.402 |
Chemical Identifiers
| CAS Number | 4747-07-3 |
|---|---|
| SMILES | CCCCCCOC |
| InChIKey | ICBJCVRQDSQPGI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexyl methyl ether (CAS 4747-07-3), with molecular formula C7H16O and molecular weight 116.12 g/mol. IUPAC: 1-methoxyhexane.
Chemical Property Profile of Hexyl methyl ether
Property Insights of Hexyl methyl ether
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexyl methyl ether. With a topological polar surface area (TPSA) of 9.2 Ų, Hexyl methyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexyl methyl ether 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 Hexyl methyl ether?
The CAS number of Hexyl methyl ether is 4747-07-3.
What is the molecular formula of Hexyl methyl ether?
The molecular formula of Hexyl methyl ether is C7H16O.
What is the molecular weight of Hexyl methyl ether?
The molecular weight of Hexyl methyl ether is 116.12 g/mol.
Where can I buy Hexyl methyl ether?
You can request a quote for Hexyl methyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexyl methyl ether?
Yes, KEHONG BIO provides custom synthesis services for Hexyl methyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.