CAS 72705-22-7

Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, ammonium salt (1:1)

Description:

Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, ammonium salt (1:1), with CAS number 72705-22-7, is a complex organic compound characterized by its sulfonic acid functional group, which contributes to its solubility in water and its acidic properties. The presence of the ammonium salt indicates that it can exist in a protonated form, enhancing its stability and solubility in various solvents. The compound features a dioxobutyl moiety, which suggests potential reactivity and interactions with biological systems, making it of interest in pharmaceutical and chemical research. Its methoxy and methyl substituents may influence its electronic properties and steric hindrance, affecting its reactivity and interactions with other molecules. Overall, this compound's unique structure and functional groups suggest potential applications in drug development, as well as in various chemical synthesis processes. However, specific safety and handling guidelines should be followed due to the presence of sulfonic acid, which can be corrosive.

Formula: C₁₂H₁₈N₂O₆S

InChI: InChI=1/C12H15NO6S.H3N/c1-7-4-9(13-12(15)5-8(2)14)10(19-3)6-11(7)20(16,17)18;/h4,6H,5H2,1-3H3,(H,13,15)(H,16,17,18);1H3

InChI key: InChIKey=ZPDRZMNAFLBUOA-UHFFFAOYSA-N

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

Synonyms:

• Acetoacet-p-Cresidine-4-Sulfonic Acid Ammonium Salt
• Ammonium 4-acetoacetylamino-5-methoxy-2-methylbenzenesulphonate
• Ammonium 5-Methoxy-2-Methyl-4-[(3-Oxobutanoyl)Amino]Benzenesulfonate
• Benzenesulfonic acid, 4-((1,3-dioxobutyl)amino)-5-methoxy-2-methyl-, ammonium salt (1:1)
• Benzenesulfonic acid, 4-((1,3-dioxobutyl)amino)-5-methoxy-2-methyl-, monoammonium salt
• 3-Acetoacetylamino-4-methoxytoluene-6-sulfonic acid ammonium salt
• AMMONIUM-5-METHOXY-2-METHYL-4-(3-OXOBUTANOYLAMINO)BENZENESULFONATE
• N-AcetoacetCresidineSulfonicAcid(AmmoniumSalt)
• Ammonium-4-acetoacetylamino-5-methoxy-2-methylbenzolsulfonat
• N-ACETOACET-P-CRESIDINE-O-SULFONIC ACID AMMONIUM SALT
• 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-benzenesulfonicacimonoammoni
• N-Acetoaceticcresidinesulfonicacidammoniumsalt
• N-AcetoacetylCresidineSulfonicAcid,AmmoniumSalt
• 4-Acetoacetylamino-5-methoxy-2-methylbenzenesulfonic acid ammonium salt
• ACETOACET CRESIDINE SULFONIC ACID AMMONIUM SALT