decylsulfanylmethyl-dodecyl-bis(2-hydroxyethyl)azanium chloride

CAS: 78865-90-4

Molecular Formula	`C27H58ClNO2S`
Molecular Weight	496.3 g/mol
Topological Polar Surface Area	65.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	26
Exact Mass	495.38766
Heavy Atoms	32
Complexity	335.0

Chemical Identifiers

CAS Number	78865-90-4
SMILES	`CCCCCCCCCCCC[N+](CCO)(CCO)CSCCCCCCCCCC.[Cl-]`
InChIKey	`QMKLVGXSOSUSEH-UHFFFAOYSA-M`

📖 Product Overview

decylsulfanylmethyl-dodecyl-bis(2-hydroxyethyl)azanium chloride (CAS: 78865-90-4) is a chemical compound with molecular formula C27H58ClNO2S and molecular weight 496.3 g/mol. Its IUPAC systematic name is decylsulfanylmethyl-dodecyl-bis(2-hydroxyethyl)azanium chloride. Topological Polar Surface Area 65.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 26 Exact Mass 495.38766 Heavy Atoms 32 Complexity 335.0 InChI Key: QMKLVGXSOSUSEH-UHFFFAOYSA-M. SMILES: CCCCCCCCCCCC[N+](CCO)(CCO)CSCCCCCCCCCC.[Cl-].

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