Butane, 1-chloro-4-(1-ethoxyethoxy)-
TL;DR: Butane, 1-chloro-4-(1-ethoxyethoxy)- (CAS 52500-29-5) is a chemical compound with molecular formula C8H17ClO2 and molecular weight 180.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(1-ethoxyethoxy)butane
Also Known As: 1-Chloro-4-(1-ethoxyethoxy)butane, 1-Chlor-3-(1'-aethoxyaethoxy)-butan, 1-Chloro-4-(1-ethoxyethoxy)butane #, Butane, 1-chloro-4-(1-ethoxyethoxy)-
| Molecular Formula | C8H17ClO2 |
|---|---|
| Molecular Weight | 180.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 180.0917 |
| Heavy Atoms | 11 |
| Complexity | 78.0 |
Chemical Identifiers
| CAS Number | 52500-29-5 |
|---|---|
| SMILES | CCOC(C)OCCCCCl |
| InChIKey | OQXBWEGKIRSTOJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butane, 1-chloro-4-(1-ethoxyethoxy)- (CAS 52500-29-5), with molecular formula C8H17ClO2 and molecular weight 180.09 g/mol. IUPAC: 1-chloro-4-(1-ethoxyethoxy)butane.
Chemical Property Profile of Butane, 1-chloro-4-(1-ethoxyethoxy)-
Property Insights of Butane, 1-chloro-4-(1-ethoxyethoxy)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butane, 1-chloro-4-(1-ethoxyethoxy)-. With a topological polar surface area (TPSA) of 18.5 Ų, Butane, 1-chloro-4-(1-ethoxyethoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane, 1-chloro-4-(1-ethoxyethoxy)- 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 Butane, 1-chloro-4-(1-ethoxyethoxy)-?
The CAS number of Butane, 1-chloro-4-(1-ethoxyethoxy)- is 52500-29-5.
What is the molecular formula of Butane, 1-chloro-4-(1-ethoxyethoxy)-?
The molecular formula of Butane, 1-chloro-4-(1-ethoxyethoxy)- is C8H17ClO2.
What is the molecular weight of Butane, 1-chloro-4-(1-ethoxyethoxy)-?
The molecular weight of Butane, 1-chloro-4-(1-ethoxyethoxy)- is 180.09 g/mol.
Where can I buy Butane, 1-chloro-4-(1-ethoxyethoxy)-?
You can request a quote for Butane, 1-chloro-4-(1-ethoxyethoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane, 1-chloro-4-(1-ethoxyethoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Butane, 1-chloro-4-(1-ethoxyethoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.