[5-hydroxy-3-[hydroxy(phenyl)methyl]-1-benzofuran-4-yl]methyl-dimethylazanium chloride

CAS: 29540-35-0

Molecular Formula	`C18H20ClNO3`
Molecular Weight	333.8 g/mol
Topological Polar Surface Area	58.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	333.11316
Heavy Atoms	23
Complexity	356.0

Chemical Identifiers

CAS Number	29540-35-0
SMILES	`C[NH+](C)CC1=C(C=CC2=C1C(=CO2)C(C3=CC=CC=C3)O)O.[Cl-]`
InChIKey	`ZZMIMGCANUQYKF-UHFFFAOYSA-N`

📖 Product Overview

[5-hydroxy-3-[hydroxy(phenyl)methyl]-1-benzofuran-4-yl]methyl-dimethylazanium chloride (CAS: 29540-35-0) is a chemical compound with molecular formula C18H20ClNO3 and molecular weight 333.8 g/mol. Its IUPAC systematic name is [5-hydroxy-3-[hydroxy(phenyl)methyl]-1-benzofuran-4-yl]methyl-dimethylazanium chloride. Topological Polar Surface Area 58.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 4 Rotatable Bonds 4 Exact Mass 333.11316 Heavy Atoms 23 Complexity 356.0 InChI Key: ZZMIMGCANUQYKF-UHFFFAOYSA-N. SMILES: C[NH+](C)CC1=C(C=CC2=C1C(=CO2)C(C3=CC=CC=C3)O)O.[Cl-].

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