Isoindolinium, hexahydro-2-methyl-2-(3-(4-methyl-4-morpholinio)propyl)-, diiodide

4-methyl-4-[3-(2-methyl-1,4,5,6,7,7a-hexahydroisoindol-2-ium-2-yl)propyl]morpholin-4-ium diiodide

CAS: 6309-72-4

Molecular Formula	`C17H32I2N2O`
Molecular Weight	534.3 g/mol
Topological Polar Surface Area	9.2 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	4
Exact Mass	534.0604
Heavy Atoms	22
Complexity	373.0

Chemical Identifiers

CAS Number	6309-72-4
SMILES	`C[N+]1(CCOCC1)CCC[N+]2(CC3CCCCC3=C2)C.[I-].[I-]`
InChIKey	`DBOKICSTEJGKTH-UHFFFAOYSA-L`

📖 Product Overview

Isoindolinium, hexahydro-2-methyl-2-(3-(4-methyl-4-morpholinio)propyl)-, diiodide (CAS: 6309-72-4) is a chemical compound with molecular formula C17H32I2N2O and molecular weight 534.3 g/mol. Its IUPAC systematic name is 4-methyl-4-[3-(2-methyl-1,4,5,6,7,7a-hexahydroisoindol-2-ium-2-yl)propyl]morpholin-4-ium diiodide. Topological Polar Surface Area 9.2 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 4 Exact Mass 534.0604 Heavy Atoms 22 Complexity 373.0 InChI Key: DBOKICSTEJGKTH-UHFFFAOYSA-L. SMILES: C[N+]1(CCOCC1)CCC[N+]2(CC3CCCCC3=C2)C.[I-].[I-].

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