α-NETA - ≥97% , CAS No.31059-54-8

CAS: 31059-54-8 Cat. No.: N344157 Fórmula: C₁₆H₂₀INO Peso molecular: 369.24 PubChem CID: 169245

GRAU & PUREZA ≥97%

Synonyms

2-(beta-Naphthoyl)ethyltrimethylammonium iodide | DTXSID60953164 | AKOS040741094 | N,N,N-trimethyl-3-(naphthalen-2-yl)-3-oxopropan-1-aminium iodide | HY-124957 | 2-Naphthalenepropanaminium, N,N,N-trimethyl-gamma-oxo-, iodide (1:1) | trimethyl-(3-naphthale

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Visão geral

α-NETA is a potent, fluorescent inhibitor of Choactase (choline acetyltransferase).

Especificações

Sinónimos

2-(beta-Naphthoyl)ethyltrimethylammonium iodide | DTXSID60953164 | AKOS040741094 | N,N,N-trimethyl-3-(naphthalen-2-yl)-3-oxopropan-1-aminium iodide | HY-124957 | 2-Naphthalenepropanaminium, N,N,N-trimethyl-gamma-oxo-, iodide (1:1) | trimethyl-(3-naphthale

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Tipo de ação

INHIBITOR

Pureza

≥97%

Nomes e identificadores

Sorrisos canónicos

C[N+](C)(C)CCC(=O)C1=CC2=CC=CC=C2C=C1.[I-]

IUPAC Name

trimethyl-(3-naphthalen-2-yl-3-oxopropyl)azanium;iodide

InChIKey

LIFHUGCXEAQKRZ-UHFFFAOYSA-M

INCHI

1S/C16H20NO.HI/c1-17(2,3)11-10-16(18)15-9-8-13-6-4-5-7-14(13)12-15;/h4-9,12H,10-11H2,1-3H3;1H/q+1;/p-1

SMILES isoméricas

C[N+](C)(C)CCC(=O)C1=CC2=CC=CC=C2C=C1.[I-]

WGK Alemanha

3

PubChem CID

169245

Peso molecular

369.24

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Naphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Naphthalenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenes
• Alternative Parents: Aryl alkyl ketones Beta-amino ketones Tetraalkylammonium salts Organopnictogen compounds Organic oxides Organic iodide salts Hydrocarbon derivatives Amines
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Aryl alkyl ketone - Aryl ketone - Beta-aminoketone - Tetraalkylammonium salt - Quaternary ammonium salt - Ketone - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic iodide salt - Organic salt - Organooxygen compound - Organonitrogen compound - Amine - Aromatic homopolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propriedades químicas e físicas

• Solubilidade: Soluble in methanol.
• Peso molecular: 369.240 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 369.059 Da
• Monoisotopic Mass: 369.059 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 292.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3