Hexane, mixture of isomers - ≥99% , CAS No.107-83-5

CAS: 107-83-5 Cat. No.: H661840 Peso molecular: 86.17 Beilstein Registry Number: 1730735 Número EC: 203-523-4

GRADE & PURITY ≥99%

Synonyms

Isohexane, Hexanes

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Descripción general

Hexane, mixture of isomers is a non-renewable organic solvent mainly used for the dissolution and extraction of oils and fats.Hexane, mixture of isomers may be used as a carrier phase for microfluidic devices.

Specifications

Sinónimos

Isohexane, Hexanes

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Room temperature, Argon charged

Enviado en

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Pureza

≥99%

Nombres e identificadores

• Sonrisas canónicas: CCCC(C)C
• IUPAC Name: 2-methylpentane
• InChIKey: AFABGHUZZDYHJO-UHFFFAOYSA-N
• INCHI: 1S/C6H14/c1-4-5-6(2)3/h6H,4-5H2,1-3H3
• Isómeros SMILES: CCCC(C)C
• WGK Alemania: 2
• RTECS: SA2985000
• Número ONU: 1208
• Grupo de embalaje: II
• Peso molecular: 86.17
• Beilstein: 1730735
• Reaxy-Rn: 1730735
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1730735&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Clase Saturated hydrocarbons
      • Subclass Alkanes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Clase: Saturated hydrocarbons
• Subclass: Alkanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Branched alkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Branched alkane - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as branched alkanes. These are acyclic branched hydrocarbons having the general formula CnH2n+2.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive
• Índice de refracción: 1.379
• Punto de inflamación (°F): -9.4℉
• Punto de inflamación (°C): -23 ℃
• Punto de ebullición (°C): 68-70 °C
• Punto de fusión (°C): -95°C
• Peso molecular: 86.180 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 86.1096 Da
• Monoisotopic Mass: 86.1096 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 21.200
• 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

Referencias

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