Cas no 28823-41-8 (2,4-Hexadiene,2-methyl-)

2,4-Hexadiene,2-methyl- structure
2,4-Hexadiene,2-methyl- structure
Product Name:2,4-Hexadiene,2-methyl-
CAS No:28823-41-8
MF:C7H12
MW:96.1701822280884
CID:239987
PubChem ID:520396
Update Time:2025-04-19

2,4-Hexadiene,2-methyl- Chemical and Physical Properties

Names and Identifiers

    • 2,4-Hexadiene,2-methyl-
    • 2-Methyl-2,4-hexadiene
    • 1,1,4-trimethyl-1,3-butadiene
    • 2-Methylhexa-2,4-diene
    • 28823-41-8
    • DTXSID30871361
    • Inchi: 1S/C7H12/c1-4-5-6-7(2)3/h4-6H,1-3H3
    • InChI Key: PRTJSZPCEHPORP-UHFFFAOYSA-N
    • SMILES: C(/C)(\C)=C/C=CC

Computed Properties

  • Exact Mass: 96.09396
  • Monoisotopic Mass: 96.093900383g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 1
  • Complexity: 82.2
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • Topological Polar Surface Area: 0?2
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.9

Experimental Properties

  • Density: 0.7411
  • Melting Point: -74.2°C
  • Boiling Point: 121.55°C
  • Flash Point: 1.364°C
  • Refractive Index: 1.4349 (estimate)
  • PSA: 0

2,4-Hexadiene,2-methyl- Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Hydrogen Catalysts: Ruthenium phosphide (RuP2) ,  Molybdenum phosphide (MoP) ,  Silica Gel 60 ;  2 h, 600 °C; 600 °C → 450 °C; 15 min, 450 °C
1.2 Reagents: Hydrogen ;  9 h, 100 mbar, 450 °C
Reference
A Highly Stable Bimetallic Transition Metal Phosphide Catalyst for Selective Dehydrogenation of n-Heptane
Stober, Robert; et al, ChemCatChem, 2022, 14(18),

2,4-Hexadiene,2-methyl- Preparation Products

Recommended suppliers
Shenzhen Yaoyuan R&D Center Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shenzhen Yaoyuan R&D Center Co.,Ltd
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinan Hanyu Chemical Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinan Hanyu Chemical Co.,Ltd.
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited
Jiangsu Xinsu New Materials Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangsu Xinsu New Materials Co., Ltd