3-Cyclohexyl-1-propyne - ≥97% , CAS No.17715-00-3

CAS: 17715-00-3 Cat. No.: C111193 Fórmula: C₉H₁₄ Peso molecular: 122.21 Número EC: 626-106-2

GRADE & PURITY ≥97%

Synonyms

FT-0613389 | (prop-2-yn-1-yl)cyclohexane | 3-Cyclohexylpropyne | MFCD00041562 | prop-2-ynylcyclohexane | prop-2-ynyl-cyclohexane | prop-2-yn-1-ylcyclohexane | 4-05-00-00419 (Beilstein Handbook Reference) | FT-0615568 | EN300-1852884 | Cyclohexane, 2-propy

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

FT-0613389 | (prop-2-yn-1-yl)cyclohexane | 3-Cyclohexylpropyne | MFCD00041562 | prop-2-ynylcyclohexane | prop-2-ynyl-cyclohexane | prop-2-yn-1-ylcyclohexane | 4-05-00-00419 (Beilstein Handbook Reference) | FT-0615568 | EN300-1852884 | Cyclohexane, 2-propy

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

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: 504755871
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504755871
• Sonrisas canónicas: C#CCC1CCCCC1
• IUPAC Name: prop-2-ynylcyclohexane
• InChIKey: UARFKZSJGDQRLF-UHFFFAOYSA-N
• INCHI: 1S/C9H14/c1-2-6-9-7-4-3-5-8-9/h1,9H,3-8H2
• Isómeros SMILES: C#CCC1CCCCC1
• WGK Alemania: 3
• RTECS: UK4725000
• Número ONU: 1993
• Peso molecular: 122.21
• Reaxy-Rn: 1849402
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1849402&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Acetylides

• Kingdom: Organic compounds
• Superclass: Acetylides
• Clase: Not available
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Acetylides
• Alternative Parents: Unsaturated aliphatic hydrocarbons Acetylenes
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Acetylide - Unsaturated aliphatic hydrocarbon - Unsaturated hydrocarbon - Acetylene - Hydrocarbon - Aliphatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as acetylides. These are compounds arising by replacement of one or both hydrogen atoms of acetylene (ethyne) by a metal or other cationic group. E.g. NaC#CH monosodium acetylide. By extension, analogous compounds derived from terminal acetylenes, RC#CH. The class is limited here to derivatives of acetylene where the hydrogen atom is replaced with an element with similar or lower electronegativity that carbon.
• 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

• Solubilidad: Slightly soluble in water.
• Índice de refracción: 1.459
• Punto de inflamación (°F): 95 °F
• Punto de inflamación (°C): 35°C
• Punto de ebullición (°C): 157-158°C
• Peso molecular: 122.210 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 122.11 Da
• Monoisotopic Mass: 122.11 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 109.000
• 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

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 17715-00-3, the molecular formula is C9H14, and the molecular weight is 122.21 g/mol. InChIKey UARFKZSJGDQRLF-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.