1-Fluoro-4-(prop-2-en-1-yloxy)benzene
TL;DR: 1-Fluoro-4-(prop-2-en-1-yloxy)benzene (CAS 13990-72-2) is a chemical compound with molecular formula C9H9FO and molecular weight 152.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-fluoro-4-prop-2-enoxybenzene
Also Known As: 1-fluoro-4-(prop-2-en-1-yloxy)benzene, 1-(allyloxy)-4-fluorobenzene, 3-(4-fluorophenoxy)propene, 4-allyloxy-fluorobenzene, 1-fluoro-4-prop-2-enoxybenzene
| Molecular Formula | C9H9FO |
|---|---|
| Molecular Weight | 152.06 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 152.06374 |
| Heavy Atoms | 11 |
| Complexity | 117.0 |
Chemical Identifiers
| CAS Number | 13990-72-2 |
|---|---|
| SMILES | C=CCOC1=CC=C(C=C1)F |
| InChIKey | ZBUDNSQUWYPTSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Fluoro-4-(prop-2-en-1-yloxy)benzene (CAS 13990-72-2), with molecular formula C9H9FO and molecular weight 152.06 g/mol. IUPAC: 1-fluoro-4-prop-2-enoxybenzene.
Chemical Property Profile of 1-Fluoro-4-(prop-2-en-1-yloxy)benzene
Property Insights of 1-Fluoro-4-(prop-2-en-1-yloxy)benzene
The XLogP value of 3.0 indicates that 1-Fluoro-4-(prop-2-en-1-yloxy)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Fluoro-4-(prop-2-en-1-yloxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Fluoro-4-(prop-2-en-1-yloxy)benzene 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 1-Fluoro-4-(prop-2-en-1-yloxy)benzene?
The CAS number of 1-Fluoro-4-(prop-2-en-1-yloxy)benzene is 13990-72-2.
What is the molecular formula of 1-Fluoro-4-(prop-2-en-1-yloxy)benzene?
The molecular formula of 1-Fluoro-4-(prop-2-en-1-yloxy)benzene is C9H9FO.
What is the molecular weight of 1-Fluoro-4-(prop-2-en-1-yloxy)benzene?
The molecular weight of 1-Fluoro-4-(prop-2-en-1-yloxy)benzene is 152.06 g/mol.
Where can I buy 1-Fluoro-4-(prop-2-en-1-yloxy)benzene?
You can request a quote for 1-Fluoro-4-(prop-2-en-1-yloxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Fluoro-4-(prop-2-en-1-yloxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Fluoro-4-(prop-2-en-1-yloxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.