1-Etil-4-(feniletinil)benzene - ≥98%(GC) , CAS No.92866-00-7

CAS: 92866-00-7 Cat. No.: E156082 Formula: C₁₆H₁₀ Peso molecolare: 202.26 Numero EC: 805-830-4

GRADE & PURITY ≥98%(GC)

Synonyms

4-Ethynyldiphenylacetylene | AKOS030228731 | 1-ethynyl-4-(2-phenylethynyl)benzene | 4-(phenylethynyl)phenylacetylene | A936788 | YSWG397 | E0967 | AS-61834 | MFCD27665710 | WAUKYPQSFIENDE-UHFFFAOYSA-N | 1-ethynyl-4-(phenylethynyl)benzene | T73075 | Benzen

Storage

Argon charged,Room temperature

Shipped In

Normale

Specifications

Sinonimi

4-Ethynyldiphenylacetylene | AKOS030228731 | 1-ethynyl-4-(2-phenylethynyl)benzene | 4-(phenylethynyl)phenylacetylene | A936788 | YSWG397 | E0967 | AS-61834 | MFCD27665710 | WAUKYPQSFIENDE-UHFFFAOYSA-N | 1-ethynyl-4-(phenylethynyl)benzene | T73075 | Benzen

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normale

Purezza

≥98%(GC)

Nomi e identificatori

• Pubchem Sid: 488197358
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488197358
• Sorrisi canonici: C#CC1=CC=C(C=C1)C#CC2=CC=CC=C2
• IUPAC Name: 1-ethynyl-4-(2-phenylethynyl)benzene
• InChIKey: WAUKYPQSFIENDE-UHFFFAOYSA-N
• INCHI: 1S/C16H10/c1-2-14-8-10-16(11-9-14)13-12-15-6-4-3-5-7-15/h1,3-11H
• Isomeri SMILES: C#CC1=CC=C(C=C1)C#CC2=CC=CC=C2
• Peso molecolare: 202.26
• Reaxy-Rn: 2556287
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2556287&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Aromatic hydrocarbons Acetylides Acetylenes
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Monocyclic benzene moiety - Aromatic hydrocarbon - Acetylide - Unsaturated hydrocarbon - Acetylene - Hydrocarbon - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• 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

Proprietà chimiche e fisiche

• Sensibilità: Light & air sensitive
• Punto di fusione (°C): 88-92℃
• Peso molecolare: 202.250 g/mol
• XLogP3: 5.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 202.078 Da
• Monoisotopic Mass: 202.078 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 315.000
• 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