4,5-Dimethoxy-2-(1H-pyrrol-1-yl)benzonitrile structure

4,5-Dimethoxy-2-(1H-pyrrol-1-yl)benzonitrile

4,5-dimethoxy-2-pyrrol-1-ylbenzonitrile

Also Known As: 4,5-dimethoxy-2-(1H-pyrrol-1-yl)benzonitrile|ZERO/005482|4,5-Dimethoxy-2-pyrrol-1-yl-benzonitrile|4,5-dimethoxy-2-pyrrol-1-ylbenzonitrile|4,5-dimethoxy-2-pyrrolylbenzenecarbonitrile|Benzonitrile, 4,5-dimethoxy-2-(1H-pyrrol-1-yl)-

CAS: 883291-39-2
Molecular Formula C13H12N2O2
Molecular Weight 228.08987 g/mol
LogP 2.36618
Topological Polar Surface Area 47.18 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 228.08987
Monoisotopic Mass 228.08987
Heavy Atoms 17
Complexity 553.5387

Chemical Identifiers

CAS Number 883291-39-2
SMILES COC1=C(C=C(C(=C1)C#N)N2C=CC=C2)OC

Product Overview

4,5-Dimethoxy-2-(1H-pyrrol-1-yl)benzonitrile (CAS 883291-39-2), with molecular formula C13H12N2O2 and molecular weight 228.08987 g/mol. IUPAC: 4,5-dimethoxy-2-pyrrol-1-ylbenzonitrile.

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