diethyl-methyl-[2-(1-phenylsulfanylcyclobutanecarbonyl)oxyethyl]azanium iodide

CAS: 101361-01-7

Molecular Formula	`C18H28INO2S`
Molecular Weight	449.4 g/mol
Topological Polar Surface Area	51.6 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	9
Exact Mass	449.08856
Heavy Atoms	23
Complexity	358.0

Chemical Identifiers

CAS Number	101361-01-7
SMILES	`CC[N+](C)(CC)CCOC(=O)C1(CCC1)SC2=CC=CC=C2.[I-]`
InChIKey	`UYEHBGUFDKQNEZ-UHFFFAOYSA-M`

📖 Product Overview

diethyl-methyl-[2-(1-phenylsulfanylcyclobutanecarbonyl)oxyethyl]azanium iodide (CAS: 101361-01-7) is a chemical compound with molecular formula C18H28INO2S and molecular weight 449.4 g/mol. Its IUPAC systematic name is diethyl-methyl-[2-(1-phenylsulfanylcyclobutanecarbonyl)oxyethyl]azanium iodide. Topological Polar Surface Area 51.6 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 9 Exact Mass 449.08856 Heavy Atoms 23 Complexity 358.0 InChI Key: UYEHBGUFDKQNEZ-UHFFFAOYSA-M. SMILES: CC[N+](C)(CC)CCOC(=O)C1(CCC1)SC2=CC=CC=C2.[I-].

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