2-(4-Amino-3-Sulphophenyl)-6-Methylbenzothiazole-7-Sulphonic Acid
[CAS# 5855-98-1]

Identification

• Name: 2-(4-Amino-3-Sulphophenyl)-6-Methylbenzothiazole-7-Sulphonic Acid
• Synonyms: 2-(4-Amino-3-Sulfo-Phenyl)-6-Methyl-1,3-Benzothiazole-7-Sulfonic Acid; 2-(4'-Aminophenyl)-6-Methylbenzene-Thiazole-3',7-Disulfonic Acid; 2-(4-Amino-3-Sulphophenyl)-6-Methylbenzothiazole-7-Sulphonic Acid
• Molecular Formula: C₁₄H₁₂N₂O₆S₃
• Molecular Weight: 400.44
• CAS Registry Number: 5855-98-1
• EINECS: 227-471-7
• SMILES: C1=CC(=C(C2=C1N=C(S2)C3=CC(=C(N)C=C3)[S](O)(=O)=O)[S](O)(=O)=O)C
• InChI: 1S/C14H12N2O6S3/c1-7-2-5-10-12(13(7)25(20,21)22)23-14(16-10)8-3-4-9(15)11(6-8)24(17,18)19/h2-6H,15H2,1H3,(H,17,18,19)(H,20,21,22)
• InChIKey: ANZCWTMNWQPOQI-UHFFFAOYSA-N

Properties

• Density: 1.699g/cm³ (Cal.)