Compound C13H14BrNO3

6-ethyl-4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide

CAS: 15248-43-8

Molecular Formula	`C13H14BrNO3`
Molecular Weight	312.16 g/mol
Topological Polar Surface Area	31.6 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	311.01572
Heavy Atoms	18
Complexity	273.0

Chemical Identifiers

CAS Number	15248-43-8
SMILES	`CC[N+]1=CC2=C(C3=C(C=C2C=C1)OCO3)OC.[Br-]`
InChIKey	`VAKHCRLGGIOBOS-UHFFFAOYSA-M`

📖 Product Overview

Compound C13H14BrNO3 (CAS: 15248-43-8) is a chemical compound with molecular formula C13H14BrNO3 and molecular weight 312.16 g/mol. Its IUPAC systematic name is 6-ethyl-4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide. Topological Polar Surface Area 31.6 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 2 Exact Mass 311.01572 Heavy Atoms 18 Complexity 273.0 InChI Key: VAKHCRLGGIOBOS-UHFFFAOYSA-M. SMILES: CC[N+]1=CC2=C(C3=C(C=C2C=C1)OCO3)OC.[Br-].

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