Ethyl cyanate
TL;DR: Ethyl cyanate (CAS 627-48-5) is a chemical compound with molecular formula C3H5NO and molecular weight 71.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl cyanate
Also Known As: Ethyl cyanate, cyanoethylate, Cyanic acid, ethyl ester, Cyanic acid ethyl ester, RefChem:138897
| Molecular Formula | C3H5NO |
|---|---|
| Molecular Weight | 71.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 71.03712 |
| Heavy Atoms | 5 |
| Complexity | 51.0 |
Chemical Identifiers
| CAS Number | 627-48-5 |
|---|---|
| SMILES | CCOC#N |
| InChIKey | JXBPSENIJJPTCI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl cyanate (CAS 627-48-5), with molecular formula C3H5NO and molecular weight 71.04 g/mol. IUPAC: ethyl cyanate.
Chemical Property Profile of Ethyl cyanate
Property Insights of Ethyl cyanate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl cyanate. With a topological polar surface area (TPSA) of 33.0 Ų, Ethyl cyanate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl cyanate 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 Ethyl cyanate?
The CAS number of Ethyl cyanate is 627-48-5.
What is the molecular formula of Ethyl cyanate?
The molecular formula of Ethyl cyanate is C3H5NO.
What is the molecular weight of Ethyl cyanate?
The molecular weight of Ethyl cyanate is 71.04 g/mol.
Where can I buy Ethyl cyanate?
You can request a quote for Ethyl cyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl cyanate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl cyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.