[3-cyano-4-methyl-3-(naphthalen-1-ylmethyl)pentyl]-bis(3-methylbut-2-enyl)azanium chloride

CAS: 50765-83-8

Molecular Formula	`C28H39ClN2`
Molecular Weight	439.1 g/mol
Topological Polar Surface Area	28.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	2
Rotatable Bonds	10
Exact Mass	438.28018
Heavy Atoms	31
Complexity	606.0

Chemical Identifiers

CAS Number	50765-83-8
SMILES	`CC(C)C(CC[NH+](CC=C(C)C)CC=C(C)C)(CC1=CC=CC2=CC=CC=C21)C#N.[Cl-]`
InChIKey	`PXUVKPNONSFCNO-UHFFFAOYSA-N`

📖 Product Overview

[3-cyano-4-methyl-3-(naphthalen-1-ylmethyl)pentyl]-bis(3-methylbut-2-enyl)azanium chloride (CAS: 50765-83-8) is a chemical compound with molecular formula C28H39ClN2 and molecular weight 439.1 g/mol. Its IUPAC systematic name is [3-cyano-4-methyl-3-(naphthalen-1-ylmethyl)pentyl]-bis(3-methylbut-2-enyl)azanium chloride. Topological Polar Surface Area 28.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 2 Rotatable Bonds 10 Exact Mass 438.28018 Heavy Atoms 31 Complexity 606.0 InChI Key: PXUVKPNONSFCNO-UHFFFAOYSA-N. SMILES: CC(C)C(CC[NH+](CC=C(C)C)CC=C(C)C)(CC1=CC=CC2=CC=CC=C21)C#N.[Cl-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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📚 Academic Support

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for [3-cyano-4-methyl-3-(naphthalen-1-ylmethyl)pentyl]-bis(3-methylbut-2-enyl)azanium chloride.

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