Sulphonyl diisocyanate
TL;DR: Sulphonyl diisocyanate (CAS 4223-09-0) is a chemical compound with molecular formula C2N2O4S and molecular weight 147.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sulfuryl diisocyanate
Also Known As: sulfuryl diisocyanate, Sulphonyl diisocyanate, sulfonyl isocyanate, sulfonylisocyanate, Sulfonyldiisocyanat
| Molecular Formula | C2N2O4S |
|---|---|
| Molecular Weight | 147.96 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 147.95787 |
| Heavy Atoms | 9 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 4223-09-0 |
|---|---|
| SMILES | C(=NS(=O)(=O)N=C=O)=O |
| InChIKey | BUXTXUBQAKIQKS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sulphonyl diisocyanate (CAS 4223-09-0), with molecular formula C2N2O4S and molecular weight 147.96 g/mol. IUPAC: sulfuryl diisocyanate.
Chemical Property Profile of Sulphonyl diisocyanate
Property Insights of Sulphonyl diisocyanate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulphonyl diisocyanate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulphonyl diisocyanate. Following Lipinski's Rule of Five, Sulphonyl diisocyanate has 0 hydrogen bond donor(s) and 6 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 Sulphonyl diisocyanate?
The CAS number of Sulphonyl diisocyanate is 4223-09-0.
What is the molecular formula of Sulphonyl diisocyanate?
The molecular formula of Sulphonyl diisocyanate is C2N2O4S.
What is the molecular weight of Sulphonyl diisocyanate?
The molecular weight of Sulphonyl diisocyanate is 147.96 g/mol.
Where can I buy Sulphonyl diisocyanate?
You can request a quote for Sulphonyl diisocyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulphonyl diisocyanate?
Yes, KEHONG BIO provides custom synthesis services for Sulphonyl diisocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.