2-(1H-Indole-3-carboxaMido)benzoic acid

For Research Use Only.
Category
Alkaloids
Cat.No.
NP0155
CAS
171817-95-1
Product Name
2-(1H-Indole-3-carboxaMido)benzoic acid
Structure

Product Details

Description
2-(1H-Indole-3-carboxamido)benzoic acid is an alkaloid isolated from Isatis idigotica.
Synonyms
2-(1H-Indole-3-carboxamido)benzoic acid; 171817-95-1; 2-(1H-indole-3-carbonylamino)benzoic acid2-[(1H-Indol-3-ylcarbonyl)amino]benzoic acid; HY-N1643
IUPAC Name
2-(1H-indole-3-carbonylamino)benzoic acid
Molecular Weight
280.283
Molecular Formula
C16H12N2O3
Canonical SMILES
C1=CC=C2C(=C1)C(=CN2)C(=O)NC3=CC=CC=C3C(=O)O
InChI
InChI=1S/C16H12N2O3/c19-15(12-9-17-13-7-3-1-5-10(12)13)18-14-8-4-2-6-11(14)16(20)21/h1-9,17H,(H,18,19)(H,20,21)
InChIKey
DRWUBVFXVNQIND-UHFFFAOYSA-N
Boiling Point
456.4±25.0°C (Predicted)
Melting Point
248°C (acetic acid )
Purity
98.0%
Density
1.450±0.06 g/cm3(Predicted)
Appearance
Brown powder
Form
Powder
pKa
3.49±0.36(Predicted)
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