(5,5-diethyl-4,6-dioxo-1H-pyridin-3-yl)methyl 3,4,5-trimethoxybenzoate

CAS: 55798-57-7

Molecular Formula	`C20H25NO7`
Molecular Weight	391.4 g/mol
LogP	2.3
Topological Polar Surface Area	100.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	9
Exact Mass	391.16312
Heavy Atoms	28
Complexity	612.0

Chemical Identifiers

CAS Number	55798-57-7
SMILES	`CCC1(C(=O)C(=CNC1=O)COC(=O)C2=CC(=C(C(=C2)OC)OC)OC)CC`
InChIKey	`PYPJQQVSWUHBLH-UHFFFAOYSA-N`

📖 Product Overview

(5,5-diethyl-4,6-dioxo-1H-pyridin-3-yl)methyl 3,4,5-trimethoxybenzoate (CAS: 55798-57-7) is a chemical compound with molecular formula C20H25NO7 and molecular weight 391.4 g/mol. Its IUPAC systematic name is (5,5-diethyl-4,6-dioxo-1H-pyridin-3-yl)methyl 3,4,5-trimethoxybenzoate. LogP 2.3 Topological Polar Surface Area 100.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 9 Exact Mass 391.16312 Heavy Atoms 28 Complexity 612.0 InChI Key: PYPJQQVSWUHBLH-UHFFFAOYSA-N. SMILES: CCC1(C(=O)C(=CNC1=O)COC(=O)C2=CC(=C(C(=C2)OC)OC)OC)CC.

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📚 Academic Support

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