二丙醚
TL;DR: 二丙醚 (CAS 111-43-3) is a chemical compound with molecular formula C6H14O and molecular weight 102.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二丙醚
1-propoxypropane
Also Known As: Dipropyl ether, n-Propyl ether, PROPYL ETHER, Di-n-propyl ether, 1-Propoxypropane
| Molecular Formula | C6H14O |
|---|---|
| Molecular Weight | 102.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 102.10446 |
| Heavy Atoms | 7 |
| Complexity | 23.0 |
| Melting Point | -122 °C |
| Boiling Point | 89-91 °C |
| Density | 0.7466 at 20 °C |
| Solubility | Soluble in alcohol, ether |
| Flash Point | 21.1 °C (NFPA, 2010) |
| Vapor Pressure | 62.5 [mmHg] |
| Refractive Index | 1.3807 at 20 °C |
Chemical Identifiers
| CAS Number | 111-43-3 |
|---|---|
| SMILES | CCCOCCC |
| InChIKey | POLCUAVZOMRGSN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二丙醚 (CAS 111-43-3), with molecular formula C6H14O and molecular weight 102.10 g/mol. IUPAC: 1-propoxypropane.
Chemical Property Profile of 二丙醚
Property Insights of 二丙醚
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二丙醚. With a topological polar surface area (TPSA) of 9.2 Ų, 二丙醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二丙醚 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 二丙醚?
The CAS number of 二丙醚 is 111-43-3.
What is the molecular formula of 二丙醚?
The molecular formula of 二丙醚 is C6H14O.
What is the molecular weight of 二丙醚?
The molecular weight of 二丙醚 is 102.10 g/mol.
Where can I buy 二丙醚?
You can request a quote for 二丙醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二丙醚?
Yes, KEHONG BIO provides custom synthesis services for 二丙醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.