3-[(Tert-Butylamino)Sulfonyl]-4-Chlorobenzoic Acid
[CAS# 59815-50-8]

Identification

• Name: 3-[(Tert-Butylamino)Sulfonyl]-4-Chlorobenzoic Acid
• Synonyms: 3-(Tert-Butylsulfamoyl)-4-Chloro-Benzoate; Zinc03278395
• Molecular Formula: C₁₁H₁₃ClNO₄S
• Molecular Weight: 290.74
• CAS Registry Number: 59815-50-8
• SMILES: C1=C(C=CC(=C1[S](=O)(=O)NC(C)(C)C)Cl)C([O-])=O
• InChI: 1S/C11H14ClNO4S/c1-11(2,3)13-18(16,17)9-6-7(10(14)15)4-5-8(9)12/h4-6,13H,1-3H3,(H,14,15)/p-1
• InChIKey: CICPHGOQDCGVPX-UHFFFAOYSA-M

Properties

• Boiling point: 460.079°C at 760 mmHg (Cal.)
• Flash point: 232.048°C (Cal.)