Compound C18H35I2N3O

1-(9,9-dimethyl-3-aza-9-azoniabicyclo[3.3.1]nonan-3-yl)-3-(1-methylpiperidin-1-ium-1-yl)propan-1-one diiodide

CAS: 102585-73-9

Molecular Formula	`C18H35I2N3O`
Molecular Weight	563.3 g/mol
Topological Polar Surface Area	20.3 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	563.087
Heavy Atoms	24
Complexity	399.0

Chemical Identifiers

CAS Number	102585-73-9
SMILES	`C[N+]1(C2CCCC1CN(C2)C(=O)CC[N+]3(CCCCC3)C)C.[I-].[I-]`
InChIKey	`MKILHVUQGLPRBJ-UHFFFAOYSA-L`

📖 Product Overview

Compound C18H35I2N3O (CAS: 102585-73-9) is a chemical compound with molecular formula C18H35I2N3O and molecular weight 563.3 g/mol. Its IUPAC systematic name is 1-(9,9-dimethyl-3-aza-9-azoniabicyclo[3.3.1]nonan-3-yl)-3-(1-methylpiperidin-1-ium-1-yl)propan-1-one diiodide. Topological Polar Surface Area 20.3 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 563.087 Heavy Atoms 24 Complexity 399.0 InChI Key: MKILHVUQGLPRBJ-UHFFFAOYSA-L. SMILES: C[N+]1(C2CCCC1CN(C2)C(=O)CC[N+]3(CCCCC3)C)C.[I-].[I-].

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