1,1'-Sulfonylbis(4-chloro-3-isothiocyanatobenzene)
1-chloro-4-(4-chloro-3-isothiocyanatophenyl)sulfonyl-2-isothiocyanatobenzene
Also Known As: 1,1'-sulfonylbis(4-chloro-3-isothiocyanatobenzene)|KST-1B4086|1-chloro-4-(4-chloro-3-isothiocyanatophenyl)sulfonyl-2-isoth|1-chloro-4-(4-chloro-3-isothiocyanatophenyl)sulfonyl-2-isothiocyanatobenzene
CAS: 40939-77-3
| Molecular Formula | C14H6Cl2N2O2S3 |
|---|---|
| Molecular Weight | 399.89685 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.89685 |
| Monoisotopic Mass | 399.89685 |
| Heavy Atoms | 23 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 40939-77-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)C2=CC(=C(C=C2)Cl)N=C=S)N=C=S)Cl |
| InChIKey | FHJHLWIUWGIZCO-UHFFFAOYSA-N |
Product Overview
1,1'-Sulfonylbis(4-chloro-3-isothiocyanatobenzene) (CAS 40939-77-3), with molecular formula C14H6Cl2N2O2S3 and molecular weight 399.89685 g/mol. IUPAC: 1-chloro-4-(4-chloro-3-isothiocyanatophenyl)sulfonyl-2-isothiocyanatobenzene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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1,1'-Sulfonylbis(4-chloro-3-isothiocyanatobenzene) is a custom synthesis product. We offer services from milligram to kilogram scale.
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