1-Fluoro-4-(trimethylsilyl)benzene
TL;DR: 1-Fluoro-4-(trimethylsilyl)benzene (CAS 455-17-4) is a chemical compound with molecular formula C9H13FSi and molecular weight 168.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-fluorophenyl)-trimethylsilane
Also Known As: (4-fluorophenyl)trimethylsilane, 1-Fluoro-4-(trimethylsilyl)benzene, 1-Fluoro-4-(trimethylsily)benzene, (4-fluorophenyl)-trimethylsilane, 4-Fluorophenyltrimethylsilane
| Molecular Formula | C9H13FSi |
|---|---|
| Molecular Weight | 168.08 g/mol |
| LogP | 2.3709 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.07706 |
| Heavy Atoms | 11 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 455-17-4 |
|---|---|
| SMILES | C[Si](C)(C)C1=CC=C(C=C1)F |
| InChIKey | VZKFVPRKXHZBQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Fluoro-4-(trimethylsilyl)benzene (CAS 455-17-4), with molecular formula C9H13FSi and molecular weight 168.08 g/mol. IUPAC: (4-fluorophenyl)-trimethylsilane.
Chemical Property Profile of 1-Fluoro-4-(trimethylsilyl)benzene
Property Insights of 1-Fluoro-4-(trimethylsilyl)benzene
The XLogP value of 2.3709 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Fluoro-4-(trimethylsilyl)benzene. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Fluoro-4-(trimethylsilyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Fluoro-4-(trimethylsilyl)benzene has 0 hydrogen bond donor(s) and 1 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-(trimethylsilyl)benzene?
The CAS number of 1-Fluoro-4-(trimethylsilyl)benzene is 455-17-4.
What is the molecular formula of 1-Fluoro-4-(trimethylsilyl)benzene?
The molecular formula of 1-Fluoro-4-(trimethylsilyl)benzene is C9H13FSi.
What is the molecular weight of 1-Fluoro-4-(trimethylsilyl)benzene?
The molecular weight of 1-Fluoro-4-(trimethylsilyl)benzene is 168.08 g/mol.
Where can I buy 1-Fluoro-4-(trimethylsilyl)benzene?
You can request a quote for 1-Fluoro-4-(trimethylsilyl)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-(trimethylsilyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Fluoro-4-(trimethylsilyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.