1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene
TL;DR: 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene (CAS 77294-15-6) is a chemical compound with molecular formula C11H12ClF and molecular weight 198.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloropent-2-en-2-yl)-4-fluorobenzene
Also Known As: EINECS 278-659-0, 1-p-Fluorophenyl-1-methyl-4-chloro-1-butene, 1-(5-CHLOROPENT-2-EN-2-YL)-4-FLUOROBENZENE, 1-(4-Chloro-1-methyl-1-butenyl)-4-fluorobenzene, 1-[(E)-5-chloropent-2-en-2-yl]-4-fluorobenzene
| Molecular Formula | C11H12ClF |
|---|---|
| Molecular Weight | 198.06 g/mol |
| LogP | 3.8579 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.06116 |
| Heavy Atoms | 13 |
| Complexity | 287.46353 |
Chemical Identifiers
| CAS Number | 77294-15-6 |
|---|---|
| SMILES | CC(=CCCCl)C1=CC=C(C=C1)F |
Product Overview
1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene (CAS 77294-15-6), with molecular formula C11H12ClF and molecular weight 198.06 g/mol. IUPAC: 1-(5-chloropent-2-en-2-yl)-4-fluorobenzene.
Chemical Property Profile of 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene
Property Insights of 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene
The XLogP value of 3.8579 indicates that 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene has 0 hydrogen bond donor(s) and 0 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 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene?
The CAS number of 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene is 77294-15-6.
What is the molecular formula of 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene?
The molecular formula of 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene is C11H12ClF.
What is the molecular weight of 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene?
The molecular weight of 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene is 198.06 g/mol.
Where can I buy 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene?
You can request a quote for 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Chloropent-2-EN-2-YL)-4-fluorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.