Compound C21H34N2O4

4-hydroxy-4-oxobutanoate;6-(4-piperidin-1-ium-1-ylphenyl)hexan-1-amine

CAS: 71825-26-8

Molecular Formula	`C21H34N2O4`
Molecular Weight	378.5 g/mol
Topological Polar Surface Area	108.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	9
Exact Mass	378.25186
Heavy Atoms	27
Complexity	316.0

Chemical Identifiers

CAS Number	71825-26-8
SMILES	`C1CC[NH+](CC1)C2=CC=C(C=C2)CCCCCCN.C(CC(=O)[O-])C(=O)O`
InChIKey	`CYWRFMLHVGCNHJ-UHFFFAOYSA-N`

📖 Product Overview

Compound C21H34N2O4 (CAS: 71825-26-8) is a chemical compound with molecular formula C21H34N2O4 and molecular weight 378.5 g/mol. Its IUPAC systematic name is 4-hydroxy-4-oxobutanoate;6-(4-piperidin-1-ium-1-ylphenyl)hexan-1-amine. Topological Polar Surface Area 108.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 5 Rotatable Bonds 9 Exact Mass 378.25186 Heavy Atoms 27 Complexity 316.0 InChI Key: CYWRFMLHVGCNHJ-UHFFFAOYSA-N. SMILES: C1CC[NH+](CC1)C2=CC=C(C=C2)CCCCCCN.C(CC(=O)[O-])C(=O)O.

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