2-[2,6-Dihydroxy-4-[3-(4-Hydroxyphenyl)-2-(Naphthalen-2-Ylsulfonylamino)Propoxy]Carbonylbenzoyl]-3-Hydroxybenzoic Acid
[CAS# 184592-61-8]

Identification

• Name: 2-[2,6-Dihydroxy-4-[3-(4-Hydroxyphenyl)-2-(Naphthalen-2-Ylsulfonylamino)Propoxy]Carbonylbenzoyl]-3-Hydroxybenzoic Acid
• Synonyms: 2-[2,6-Dihydroxy-4-[3-(4-Hydroxyphenyl)-2-(2-Naphthylsulfonylamino)Propoxy]Carbonyl-Benzoyl]-3-Hydroxy-Benzoic Acid; 2-[[2,6-Dihydroxy-4-[[3-(4-Hydroxyphenyl)-2-(2-Naphthylsulfonylamino)Propoxy]-Oxomethyl]Phenyl]-Oxomethyl]-3-Hydroxybenzoic Acid; 2-[2,6-Dihydroxy-4-[3-(4-Hydroxyphenyl)-2-(Naphthalen-2-Ylsulfonylamino)Propoxy]Carbonyl-Phenyl]Carbonyl-3-Hydroxy-Benzoic Acid
• Molecular Formula: C₃₄H₂₇NO₁₁S
• Molecular Weight: 657.65
• CAS Registry Number: 184592-61-8
• SMILES: C1=C(O)C(=C(C=C1C(OCC(N[S](C3=CC2=CC=CC=C2C=C3)(=O)=O)CC4=CC=C(C=C4)O)=O)O)C(C5=C(C(=O)O)C=CC=C5O)=O
• InChI: 1S/C34H27NO11S/c36-24-11-8-19(9-12-24)14-23(35-47(44,45)25-13-10-20-4-1-2-5-21(20)15-25)18-46-34(43)22-16-28(38)31(29(39)17-22)32(40)30-26(33(41)42)6-3-7-27(30)37/h1-13,15-17,23,35-39H,14,18H2,(H,41,42)
• InChIKey: CHWIXPJSXKQFCT-UHFFFAOYSA-N

Properties

• Density: 1.512g/cm³ (Cal.)
• Boiling point: 968.988°C at 760 mmHg (Cal.)
• Flash point: 539.825°C (Cal.)