1-Ethynylnaphthalene - ≥97% , CAS No.15727-65-8

CAS: 15727-65-8 Cat. No.: E303011 Fórmula: C₁₂H₈ Peso molecular: 152.19 Número CE: 627-307-8

GRADE & PURITY ≥97%

Synonyms

HY-111430 | EN300-1254862 | AMY19110 | I+/--ethynylnaphthalene | 1-Ethynylnaphthalene | 1-ethynyl-naphthalene | MFCD02093737 | MS-20422 | PD102345 | STL556117 | FT-0723095 | 1-naphthylacetylene | InChI=1/C12H8/c1-2-10-7-5-8-11-6-3-4-9-12(10)11/h1,3-9 | al

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Visão geral

description：

Ethynylnaphthalene can be prepared from 1-acetonaphthone or 1-naphthyl-2-trimethylsilylacetylene.

application：

1-Ethynylnaphthalene may be used to synthesize bis-6,6′-(ethynyl-1-naphthalene)-2,2′-bipyridine.

Specifications

Sinónimos

HY-111430 | EN300-1254862 | AMY19110 | I+/--ethynylnaphthalene | 1-Ethynylnaphthalene | 1-ethynyl-naphthalene | MFCD02093737 | MS-20422 | PD102345 | STL556117 | FT-0723095 | 1-naphthylacetylene | InChI=1/C12H8/c1-2-10-7-5-8-11-6-3-4-9-12(10)11/h1,3-9 | al

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

• Pubchem Sid: 504756919
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504756919
• Sorrisos canónicos: C#CC1=CC=CC2=CC=CC=C21
• IUPAC Name: 1-ethynylnaphthalene
• InChIKey: MCZUXEWWARACSP-UHFFFAOYSA-N
• INCHI: 1S/C12H8/c1-2-10-7-5-8-11-6-3-4-9-12(10)11/h1,3-9H
• SMILES isoméricas: C#CC1=CC=CC2=CC=CC=C21
• WGK Alemanha: 3
• Número UN: 1993
• Grupo de embalagem: III
• Peso molecular: 152.19
• Reaxy-Rn: 2039379
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2039379&ln=

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: Aromatic hydrocarbons Polycyclic hydrocarbons Acetylides Acetylenes
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Acetylide - Unsaturated hydrocarbon - Acetylene - Hydrocarbon - 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

• Índice de refração: n20/D 1.6500 (lit.)
• Ponto de inflamação (°F): 134.6 °F
• Ponto de inflamação (°C): 57 °C
• Peso molecular: 152.190 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 152.063 Da
• Monoisotopic Mass: 152.063 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 195.000
• 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: 1