2-Ethyl-1-butene - ≥97%(GC) , CAS No.760-21-4

CAS: 760-21-4 Cat. No.: E156179 Summenformel: C₆H₁₂ Molekulargewicht: 84.16 Beilstein Registry Number: 1697100 EG-Nummer: 212-078-5

GRADE & PURITY ≥97%(GC)

Synonyms

E0067 | MFCD00009341 | Pentane, 3-methylene- | AKOS009158339 | O5MH5V756E | 3-methylidenepentane | UNII-O5MH5V756E | 3-Methylenepentane | 1-Butene, 2-ethyl- | 2-Ethyl-1-butene, 95% | InChI=1/C6H12/c1-4-6(3)5-2/h3-5H2,1-2H | 1,1-diethylethylene | EN300-786

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Specifications

Synonyme

E0067 | MFCD00009341 | Pentane, 3-methylene- | AKOS009158339 | O5MH5V756E | 3-methylidenepentane | UNII-O5MH5V756E | 3-Methylenepentane | 1-Butene, 2-ethyl- | 2-Ethyl-1-butene, 95% | InChI=1/C6H12/c1-4-6(3)5-2/h3-5H2,1-2H | 1,1-diethylethylene | EN300-786

Spezifikationen & Reinheit

≥97%(GC)

Storage

Store at 2-8°C

Verschickt in

Wet ice,FedEx DG Service

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%(GC)

Namen und Kennungen

• Pubchem Sid: 504752406
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752406
• Kanonisches Lächeln: CCC(=C)CC
• IUPAC Name: 3-methylidenepentane
• InChIKey: RYKZRKKEYSRDNF-UHFFFAOYSA-N
• INCHI: 1S/C6H12/c1-4-6(3)5-2/h3-5H2,1-2H3
• Isomere SMILES: CCC(=C)CC
• WGK Deutschland: 3
• UN-Nummer: 3295
• Molekulargewicht: 84.16
• Beilstein: 1697100
• Reaxy-Rn: 1697102
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697102&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Klasse Unsaturated hydrocarbons
      • Subclass Branched unsaturated hydrocarbons

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Klasse: Unsaturated hydrocarbons
• Subclass: Branched unsaturated hydrocarbons
• Intermediate Tree Nodes: Not available
• Direct Parent: Branched unsaturated hydrocarbons
• Alternative Parents: Unsaturated aliphatic hydrocarbons Alkenes
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Branched unsaturated hydrocarbon - Unsaturated aliphatic hydrocarbon - Olefin - Alkene - Acyclic olefin - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as branched unsaturated hydrocarbons. These are hydrocarbons that contains one or more unsaturated carbon atoms, and an aliphatic branch.
• 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

• Löslichkeit: Soluble in alcohol, and methanol. Insoluble in water.
• Brechungsindex: 1.396
• Flammpunkt (°C): -10 °C
• Siedepunkt (°C): 64°C
• Schmelzpunkt (°C): -131.5~-131 °C
• Molekulargewicht: 84.160 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 84.0939 Da
• Monoisotopic Mass: 84.0939 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 38.000
• 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