Selenocyanic acid, (4-fluorophenyl)methyl ester
TL;DR: Selenocyanic acid, (4-fluorophenyl)methyl ester (CAS 57239-46-0) is a chemical compound with molecular formula C8H6FNSe and molecular weight 214.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-fluorophenyl)methyl selenocyanate
Also Known As: 4-Fluorbenzylselenocyanat, (4-fluorophenyl)methyl selenocyanate, 1-fluoro-4-(selenocyanatomethyl)benzene, Selenocyanic acid, (4-fluorophenyl)methyl ester
| Molecular Formula | C8H6FNSe |
|---|---|
| Molecular Weight | 214.96 g/mol |
| LogP | 1.51098 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.96495 |
| Heavy Atoms | 11 |
| Complexity | 262.4157 |
Chemical Identifiers
| CAS Number | 57239-46-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C[Se]C#N)F |
Product Overview
Selenocyanic acid, (4-fluorophenyl)methyl ester (CAS 57239-46-0), with molecular formula C8H6FNSe and molecular weight 214.96 g/mol. IUPAC: (4-fluorophenyl)methyl selenocyanate.
Chemical Property Profile of Selenocyanic acid, (4-fluorophenyl)methyl ester
Property Insights of Selenocyanic acid, (4-fluorophenyl)methyl ester
The XLogP value of 1.51098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Selenocyanic acid, (4-fluorophenyl)methyl ester. With a topological polar surface area (TPSA) of 23.79 Ų, Selenocyanic acid, (4-fluorophenyl)methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Selenocyanic acid, (4-fluorophenyl)methyl ester 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 Selenocyanic acid, (4-fluorophenyl)methyl ester?
The CAS number of Selenocyanic acid, (4-fluorophenyl)methyl ester is 57239-46-0.
What is the molecular formula of Selenocyanic acid, (4-fluorophenyl)methyl ester?
The molecular formula of Selenocyanic acid, (4-fluorophenyl)methyl ester is C8H6FNSe.
What is the molecular weight of Selenocyanic acid, (4-fluorophenyl)methyl ester?
The molecular weight of Selenocyanic acid, (4-fluorophenyl)methyl ester is 214.96 g/mol.
Where can I buy Selenocyanic acid, (4-fluorophenyl)methyl ester?
You can request a quote for Selenocyanic acid, (4-fluorophenyl)methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Selenocyanic acid, (4-fluorophenyl)methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Selenocyanic acid, (4-fluorophenyl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.