2-(4-Aminosulphophenyl)-6-Methylbenzothiazole-7-Sulphonic Acid
[CAS# 95892-16-3]

Identification

• Name: 2-(4-Aminosulphophenyl)-6-Methylbenzothiazole-7-Sulphonic Acid
• Synonyms: 2-(4-Amino-2-Sulfo-Phenyl)-6-Methyl-1,3-Benzothiazole-7-Sulfonic Acid; 2-(4-Aminosulphophenyl)-6-Methylbenzothiazole-7-Sulphonic Acid
• Molecular Formula: C₁₄H₁₂N₂O₆S₃
• Molecular Weight: 400.44
• CAS Registry Number: 95892-16-3
• EINECS: 306-075-9
• SMILES: C1=C(N)C=CC(=C1[S](=O)(=O)O)C2=NC3=C(S2)C(=C(C=C3)C)[S](=O)(=O)O
• InChI: 1S/C14H12N2O6S3/c1-7-2-5-10-12(13(7)25(20,21)22)23-14(16-10)9-4-3-8(15)6-11(9)24(17,18)19/h2-6H,15H2,1H3,(H,17,18,19)(H,20,21,22)
• InChIKey: HCHWBHDUXGYWHU-UHFFFAOYSA-N

Properties

• Density: 1.699g/cm³ (Cal.)