Compound C25H30FNO9

2-[[5-[3-(4-fluorophenyl)-1-hydroxypropyl]-4,7-dimethoxy-1-benzofuran-6-yl]oxy]ethyl-dimethylazanium;2-hydroxy-2-oxoacetate

CAS: 40680-84-0

Molecular Formula	`C25H30FNO9`
Molecular Weight	507.5 g/mol
Topological Polar Surface Area	143.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	10
Rotatable Bonds	10
Exact Mass	507.19046
Heavy Atoms	36
Complexity	580.0

Chemical Identifiers

CAS Number	40680-84-0
SMILES	`C[NH+](C)CCOC1=C(C2=C(C=CO2)C(=C1C(CCC3=CC=C(C=C3)F)O)OC)OC.C(=O)(C(=O)[O-])O`
InChIKey	`ULXDDZJNNKGSFB-UHFFFAOYSA-N`

📖 Product Overview

Compound C25H30FNO9 (CAS: 40680-84-0) is a chemical compound with molecular formula C25H30FNO9 and molecular weight 507.5 g/mol. Its IUPAC systematic name is 2-[[5-[3-(4-fluorophenyl)-1-hydroxypropyl]-4,7-dimethoxy-1-benzofuran-6-yl]oxy]ethyl-dimethylazanium;2-hydroxy-2-oxoacetate. Topological Polar Surface Area 143.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 10 Rotatable Bonds 10 Exact Mass 507.19046 Heavy Atoms 36 Complexity 580.0 InChI Key: ULXDDZJNNKGSFB-UHFFFAOYSA-N. SMILES: C[NH+](C)CCOC1=C(C2=C(C=CO2)C(=C1C(CCC3=CC=C(C=C3)F)O)OC)OC.C(=O)(C(=O)[O-])O.

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