2-cyano-2-(2-oxo-1,3-dihydroindol-3-yl)acetic acid

CAS: 54744-67-1

Molecular Formula	`C11H8N2O3`
Molecular Weight	216.19 g/mol
LogP	0.3
Topological Polar Surface Area	90.2 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	216.0535
Heavy Atoms	16
Complexity	371.0

Chemical Identifiers

CAS Number	54744-67-1
SMILES	`C1=CC=C2C(=C1)C(C(=O)N2)C(C#N)C(=O)O`
InChIKey	`DQGDHSNPSSYJGU-UHFFFAOYSA-N`

📖 Product Overview

2-cyano-2-(2-oxo-1,3-dihydroindol-3-yl)acetic acid (CAS: 54744-67-1) is a chemical compound with molecular formula C11H8N2O3 and molecular weight 216.19 g/mol. Its IUPAC systematic name is 2-cyano-2-(2-oxo-1,3-dihydroindol-3-yl)acetic acid. LogP 0.3 Topological Polar Surface Area 90.2 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 2 Exact Mass 216.0535 Heavy Atoms 16 Complexity 371.0 InChI Key: DQGDHSNPSSYJGU-UHFFFAOYSA-N. SMILES: C1=CC=C2C(=C1)C(C(=O)N2)C(C#N)C(=O)O.

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