氯磺酰异氰酸酯
TL;DR: 氯磺酰异氰酸酯 (CAS 1189-71-5) is a chemical compound with molecular formula CClNO3S and molecular weight 140.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯磺酰异氰酸酯
N-(oxomethylidene)sulfamoyl chloride
Also Known As: Chlorosulfonyl isocyanate, Chlorosulfonylisocyanate, Sulfuryl chloride isocyanate, chlorsulfonyl isocyanate, Chlorosulphonyl isocyanate
| Molecular Formula | CClNO3S |
|---|---|
| Molecular Weight | 140.93 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 72.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.92874 |
| Heavy Atoms | 7 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 1189-71-5 |
|---|---|
| SMILES | C(=NS(=O)(=O)Cl)=O |
| InChIKey | WRJWRGBVPUUDLA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氯磺酰异氰酸酯 (CAS 1189-71-5), with molecular formula CClNO3S and molecular weight 140.93 g/mol. IUPAC: N-(oxomethylidene)sulfamoyl chloride.
Chemical Property Profile of 氯磺酰异氰酸酯
Property Insights of 氯磺酰异氰酸酯
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氯磺酰异氰酸酯. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 氯磺酰异氰酸酯. Following Lipinski's Rule of Five, 氯磺酰异氰酸酯 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 氯磺酰异氰酸酯?
The CAS number of 氯磺酰异氰酸酯 is 1189-71-5.
What is the molecular formula of 氯磺酰异氰酸酯?
The molecular formula of 氯磺酰异氰酸酯 is CClNO3S.
What is the molecular weight of 氯磺酰异氰酸酯?
The molecular weight of 氯磺酰异氰酸酯 is 140.93 g/mol.
Where can I buy 氯磺酰异氰酸酯?
You can request a quote for 氯磺酰异氰酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯磺酰异氰酸酯?
Yes, KEHONG BIO provides custom synthesis services for 氯磺酰异氰酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.