2-Cyanoethylurea
TL;DR: 2-Cyanoethylurea (CAS 6640-70-6) is a chemical compound with molecular formula C4H7N3O and molecular weight 113.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyanoethylurea
Also Known As: 2-Cyanoethylurea, 2-Cyanethylcarbamide, (2-Cyanoethyl)urea, n-cyanoethyl urea, 1-(2-cyanoethyl)urea
| Molecular Formula | C4H7N3O |
|---|---|
| Molecular Weight | 113.06 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 113.058914 |
| Heavy Atoms | 8 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 6640-70-6 |
|---|---|
| SMILES | C(CNC(=O)N)C#N |
| InChIKey | KXLLKSHFFVQKTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Cyanoethylurea (CAS 6640-70-6), with molecular formula C4H7N3O and molecular weight 113.06 g/mol. IUPAC: 2-cyanoethylurea.
Chemical Property Profile of 2-Cyanoethylurea
Property Insights of 2-Cyanoethylurea
The XLogP value of -1.3 indicates that 2-Cyanoethylurea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyanoethylurea. Following Lipinski's Rule of Five, 2-Cyanoethylurea has 2 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 2-Cyanoethylurea?
The CAS number of 2-Cyanoethylurea is 6640-70-6.
What is the molecular formula of 2-Cyanoethylurea?
The molecular formula of 2-Cyanoethylurea is C4H7N3O.
What is the molecular weight of 2-Cyanoethylurea?
The molecular weight of 2-Cyanoethylurea is 113.06 g/mol.
Where can I buy 2-Cyanoethylurea?
You can request a quote for 2-Cyanoethylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyanoethylurea?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyanoethylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.