乙二醇二丁醚
TL;DR: 乙二醇二丁醚 (CAS 112-48-1) is a chemical compound with molecular formula C10H22O2 and molecular weight 174.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙二醇二丁醚
1-(2-butoxyethoxy)butane
Also Known As: Ethylene glycol dibutyl ether, Dibutyl cellosolve, 1,2-DIBUTOXYETHANE, Dibutyl Oxitol, Glycol dibutyl ether
| Molecular Formula | C10H22O2 |
|---|---|
| Molecular Weight | 174.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 174.16199 |
| Heavy Atoms | 12 |
| Complexity | 64.0 |
| Melting Point | -69.1 °C |
| Boiling Point | 203.9 °C at 760 mmHg |
| Density | 0.8 - Less dense than water; will float |
| Solubility | In water, 2.0X10+3 mg/L at 20 °C |
| Flash Point | 85.0 °C |
| Vapor Pressure | 0.09 [mmHg] |
| Refractive Index | 1.4112 at 25 °C |
Chemical Identifiers
| CAS Number | 112-48-1 |
|---|---|
| SMILES | CCCCOCCOCCCC |
| InChIKey | GDXHBFHOEYVPED-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙二醇二丁醚 (CAS 112-48-1), with molecular formula C10H22O2 and molecular weight 174.16 g/mol. IUPAC: 1-(2-butoxyethoxy)butane.
Chemical Property Profile of 乙二醇二丁醚
Property Insights of 乙二醇二丁醚
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 乙二醇二丁醚. With a topological polar surface area (TPSA) of 18.5 Ų, 乙二醇二丁醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙二醇二丁醚 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 乙二醇二丁醚?
The CAS number of 乙二醇二丁醚 is 112-48-1.
What is the molecular formula of 乙二醇二丁醚?
The molecular formula of 乙二醇二丁醚 is C10H22O2.
What is the molecular weight of 乙二醇二丁醚?
The molecular weight of 乙二醇二丁醚 is 174.16 g/mol.
Where can I buy 乙二醇二丁醚?
You can request a quote for 乙二醇二丁醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙二醇二丁醚?
Yes, KEHONG BIO provides custom synthesis services for 乙二醇二丁醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.