硒氰酸苄酯
TL;DR: 硒氰酸苄酯 (CAS 4671-93-6) is a chemical compound with molecular formula C8H7NSe and molecular weight 196.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硒氰酸苄酯
benzyl selenocyanate
Also Known As: Benzyl selenocyanate, benzylselenocyanate, Selenocyanate, Benzylcyano selenide, Benzylseleno cyanide
| Molecular Formula | C8H7NSe |
|---|---|
| Molecular Weight | 196.97 g/mol |
| LogP | 1.37 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.97437 |
| Heavy Atoms | 10 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 4671-93-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[Se]C#N |
| InChIKey | WSKWDMOVMQKKQI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硒氰酸苄酯 (CAS 4671-93-6), with molecular formula C8H7NSe and molecular weight 196.97 g/mol. IUPAC: benzyl selenocyanate.
Chemical Property Profile of 硒氰酸苄酯
Property Insights of 硒氰酸苄酯
The XLogP value of 1.37 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硒氰酸苄酯. With a topological polar surface area (TPSA) of 23.8 Ų, 硒氰酸苄酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 硒氰酸苄酯 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 硒氰酸苄酯?
The CAS number of 硒氰酸苄酯 is 4671-93-6.
What is the molecular formula of 硒氰酸苄酯?
The molecular formula of 硒氰酸苄酯 is C8H7NSe.
What is the molecular weight of 硒氰酸苄酯?
The molecular weight of 硒氰酸苄酯 is 196.97 g/mol.
Where can I buy 硒氰酸苄酯?
You can request a quote for 硒氰酸苄酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硒氰酸苄酯?
Yes, KEHONG BIO provides custom synthesis services for 硒氰酸苄酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.