1-Fluorohexane - BP 92-93deg , CAS No.373-14-8

CAS: 373-14-8 Cat. No.: F1068510 Summenformel: C₆H₁₃F Molekulargewicht: 104.168 EG-Nummer: 206-763-8 PubChem CID: 9760

GRADE & PURITY BP 92-93deg

Storage

Room temperature

Specifications

Spezifikationen & Reinheit

BP 92-93deg

Storage

Room temperature

Namen und Kennungen

• Kanonisches Lächeln: CCCCCCF
• IUPAC Name: 1-fluorohexane
• InChIKey: OFERIJCSHDJMSA-UHFFFAOYSA-N
• INCHI: 1S/C6H13F/c1-2-3-4-5-6-7/h2-6H2,1H3
• Isomere SMILES: CCCCCCF
• PubChem CID: 9760
• Molekulargewicht: 104.168

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Klasse Organofluorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Klasse: Organofluorides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organofluorides
• Alternative Parents: Hydrofluorocarbons Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrofluorocarbon - Hydrocarbon derivative - Organofluoride - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as organofluorides. These are compounds containing a chemical bond between a carbon atom and a fluorine atom.
• 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

Chemische und physikalische Eigenschaften

• Siedepunkt (°C): 92-93°
• Molekulargewicht: 104.170 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 104.1 Da
• Monoisotopic Mass: 104.1 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 27.400
• 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