CAS 1017782-66-9

1,1-Dimethylethyl N-[[(3-cyanophenyl)amino]sulfonyl]carbamate

Description:

1,1-Dimethylethyl N-[[(3-cyanophenyl)amino]sulfonyl]carbamate, identified by its CAS number 1017782-66-9, is a chemical compound characterized by its unique structural features. It contains a carbamate functional group, which is indicative of its potential use in various applications, including as a pesticide or herbicide. The presence of a sulfonamide moiety suggests that it may exhibit biological activity, potentially interacting with specific enzymes or receptors. The 3-cyanophenyl group contributes to its lipophilicity and may influence its solubility and permeability in biological systems. This compound is likely to be a solid at room temperature, with stability influenced by environmental factors such as pH and temperature. Its synthesis typically involves the reaction of appropriate amines and sulfonyl chlorides, followed by carbamate formation. As with many chemical substances, safety data sheets should be consulted for handling and toxicity information, as the presence of nitrogen and sulfur in its structure may pose specific health and environmental risks.

Formula: C₁₂H₁₅N₃O₄S

InChI: InChI=1S/C12H15N3O4S/c1-12(2,3)19-11(16)15-20(17,18)14-10-6-4-5-9(7-10)8-13/h4-7,14H,1-3H3,(H,15,16)

InChI key: InChIKey=FCDRUPNQSZROAX-UHFFFAOYSA-N

SMILES: N(S(NC(OC(C)(C)C)=O)(=O)=O)C1=CC(C#N)=CC=C1

Synonyms:

• Carbamic acid, N-[[(3-cyanophenyl)amino]sulfonyl]-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl N-[[(3-cyanophenyl)amino]sulfonyl]carbamate

3-(3-Cyanophenyl)-2,2-dioxodiazathiane, N1-BOC protected

CAS: 1017782-66-9

3-(3-Cyanophenyl)-2,2-dioxodiazathiane, N1-BOC protected

Purity: 95%

Molecular weight: 297.33g/mol

Ref: 54-OR14819