Resorcinol dicyanate
TL;DR: Resorcinol dicyanate (CAS 1129-88-0) is a chemical compound with molecular formula C8H4N2O2 and molecular weight 160.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-cyanatophenyl) cyanate
Also Known As: Resorcy, Resorcinol dicyanate, 1,3-Phenylene cyanate, (3-cyanatophenyl) cyanate, 1,3-dicyanatobenzene
| Molecular Formula | C8H4N2O2 |
|---|---|
| Molecular Weight | 160.03 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 160.02728 |
| Heavy Atoms | 12 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 1129-88-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC#N)OC#N |
| InChIKey | QQZZMAPJAKOSNG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Resorcinol dicyanate (CAS 1129-88-0), with molecular formula C8H4N2O2 and molecular weight 160.03 g/mol. IUPAC: (3-cyanatophenyl) cyanate.
Chemical Property Profile of Resorcinol dicyanate
Property Insights of Resorcinol dicyanate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Resorcinol dicyanate. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Resorcinol dicyanate. Following Lipinski's Rule of Five, Resorcinol dicyanate has 0 hydrogen bond donor(s) and 4 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 Resorcinol dicyanate?
The CAS number of Resorcinol dicyanate is 1129-88-0.
What is the molecular formula of Resorcinol dicyanate?
The molecular formula of Resorcinol dicyanate is C8H4N2O2.
What is the molecular weight of Resorcinol dicyanate?
The molecular weight of Resorcinol dicyanate is 160.03 g/mol.
Where can I buy Resorcinol dicyanate?
You can request a quote for Resorcinol dicyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Resorcinol dicyanate?
Yes, KEHONG BIO provides custom synthesis services for Resorcinol dicyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.