2-(2-Propynyloxy)tetrahydropyran - ≥97% , CAS No.6089-04-9

CAS: 6089-04-9 Cat. No.: P160265 Peso molecular: 140.18 Beilstein Registry Number: 17(5)3,82 Número EC: 228-027-5 PubChem CID: 98609

GRADE & PURITY ≥97%

Synonyms

Anthralan Blue B | Tetrahydro-2-(2-propynyloxy)-2H-pyran, 98% | (RS)-tetrahydro-2-(2-propynyloxy)-2H-pyran | 2-(prop-2-yn-1-yloxy)oxane | 3,4,5,6-tetrahydro-2-(2-propynyloxy)-2H-pyran | 3-[(tetrahydro-2H-pyran-2-yl)oxy]1-propyne | 3-tetrahyropyranyloxy-1-

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

Anthralan Blue B | Tetrahydro-2-(2-propynyloxy)-2H-pyran, 98% | (RS)-tetrahydro-2-(2-propynyloxy)-2H-pyran | 2-(prop-2-yn-1-yloxy)oxane | 3, 4, 5, 6-tetrahydro-2-(2-propynyloxy)-2H-pyran | 3-[(tetrahydro-2H-pyran-2-yl)oxy]1-propyne | 3-tetrahyropyranyloxy-1-

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488187135
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488187135
• Sonrisas canónicas: C#CCOC1CCCCO1
• IUPAC Name: 2-prop-2-ynoxyoxane
• InChIKey: HQAXHIGPGBPPFU-UHFFFAOYSA-N
• INCHI: 1S/C8H12O2/c1-2-6-9-8-5-3-4-7-10-8/h1,8H,3-7H2
• Isómeros SMILES: C#CCOC1CCCCO1
• PubChem CID: 98609
• Peso molecular: 140.18
• Beilstein: 17(5)3,82
• Reaxy-Rn: 1893

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Oxanes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Oxanes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Oxanes
• Alternative Parents: Oxacyclic compounds Acetylides Acetals Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Oxane - Acetylide - Oxacycle - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as oxanes. These are compounds containing an oxane (tetrahydropyran) ring, which is a six-member saturated aliphatic heterocycle with one oxygen atom and five carbon atoms.
• 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

Propiedades químicas y físicas

• Índice de refracción: 1.46
• Punto de inflamación (°C): 59°C(lit.)
• Punto de ebullición (°C): 65°C/9mmHg(lit.)
• Peso molecular: 140.180 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 140.084 Da
• Monoisotopic Mass: 140.084 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 133.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1