Methyl selenocyanate
TL;DR: Methyl selenocyanate (CAS 2179-80-8) is a chemical compound with molecular formula C2H3NSe and molecular weight 120.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl selenocyanate
Also Known As: Methyl selenocyanate, Methylselenocyanate, Methylselenocyanide, Methylcyano selenide, (methylselanyl)carbonitrile
| Molecular Formula | C2H3NSe |
|---|---|
| Molecular Weight | 120.94 g/mol |
| LogP | 0.22 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 120.94307 |
| Heavy Atoms | 4 |
| Complexity | 41.0 |
Chemical Identifiers
| CAS Number | 2179-80-8 |
|---|---|
| SMILES | C[Se]C#N |
| InChIKey | XEWPHCLETKKJMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl selenocyanate (CAS 2179-80-8), with molecular formula C2H3NSe and molecular weight 120.94 g/mol. IUPAC: methyl selenocyanate.
Chemical Property Profile of Methyl selenocyanate
Property Insights of Methyl selenocyanate
The XLogP value of 0.22 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl selenocyanate. With a topological polar surface area (TPSA) of 23.8 Ų, Methyl selenocyanate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl selenocyanate 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 Methyl selenocyanate?
The CAS number of Methyl selenocyanate is 2179-80-8.
What is the molecular formula of Methyl selenocyanate?
The molecular formula of Methyl selenocyanate is C2H3NSe.
What is the molecular weight of Methyl selenocyanate?
The molecular weight of Methyl selenocyanate is 120.94 g/mol.
Where can I buy Methyl selenocyanate?
You can request a quote for Methyl selenocyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl selenocyanate?
Yes, KEHONG BIO provides custom synthesis services for Methyl selenocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.