(E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline
TL;DR: (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline (CAS 123452-83-5) is a chemical compound with molecular formula C15H16ClNO and molecular weight 261.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-3-chlorobut-2-enoxy]-2,8-dimethylquinoline
Also Known As: BAS 00333887, 4-(3-Chloro-but-2-enyloxy)-2,8-dimethyl-quinoline, 4-[(E)-3-chlorobut-2-enoxy]-2,8-dimethylquinoline, (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline
| Molecular Formula | C15H16ClNO |
|---|---|
| Molecular Weight | 261.09 g/mol |
| LogP | 4.37304 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.09204 |
| Heavy Atoms | 18 |
| Complexity | 600.71027 |
Chemical Identifiers
| CAS Number | 123452-83-5 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C(=CC(=N2)C)OC/C=C(\C)/Cl |
Product Overview
(E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline (CAS 123452-83-5), with molecular formula C15H16ClNO and molecular weight 261.09 g/mol. IUPAC: 4-[(E)-3-chlorobut-2-enoxy]-2,8-dimethylquinoline.
Chemical Property Profile of (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline
Property Insights of (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline
The XLogP value of 4.37304 indicates that (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.12 Ų, (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline 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 (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline?
The CAS number of (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline is 123452-83-5.
What is the molecular formula of (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline?
The molecular formula of (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline is C15H16ClNO.
What is the molecular weight of (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline?
The molecular weight of (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline is 261.09 g/mol.
Where can I buy (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline?
You can request a quote for (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-((3-chlorobut-2-en-1-yl)oxy)-2,8-dimethylquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.