Cas no 2177-30-2 (4,4-dimethylpent-1-en-3-one)

4,4-dimethylpent-1-en-3-one structure
4,4-dimethylpent-1-en-3-one structure
Product Name:4,4-dimethylpent-1-en-3-one
CAS No:2177-30-2
MF:C7H12O
MW:112.169582366943
MDL:MFCD18072789
CID:1404331
PubChem ID:3014080
Update Time:2025-04-20

4,4-dimethylpent-1-en-3-one Chemical and Physical Properties

Names and Identifiers

    • 4,4-dimethylpent-1-en-3-one
    • 1-Penten-3-one, 4,4-dimethyl-
    • 4,4-Dimethyl-1-penten-3-one
    • t-butyl vinyl ketone
    • 4,4-dimethyl-pent-1-en-3-one
    • SCHEMBL1142747
    • DTXSID20176170
    • 2,2-dimethylpent-4-en-3-one
    • AKOS011342378
    • SCHEMBL22448230
    • EN300-60338
    • G46899
    • Z940201244
    • MUOKXXOKLLKNIE-UHFFFAOYSA-N
    • 2177-30-2
    • MDL: MFCD18072789
    • Inchi: 1S/C7H12O/c1-5-6(8)7(2,3)4/h5H,1H2,2-4H3
    • InChI Key: MUOKXXOKLLKNIE-UHFFFAOYSA-N
    • SMILES: O=C(C=C)C(C)(C)C

Computed Properties

  • Exact Mass: 112.08886
  • Monoisotopic Mass: 112.089
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 2
  • Complexity: 106
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.9
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • Density: 0.822
  • Boiling Point: 140.1°C at 760 mmHg
  • Flash Point: 35.1°C
  • Refractive Index: 1.415
  • PSA: 17.07

4,4-dimethylpent-1-en-3-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
D455905-25mg
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$ 50.00 2022-06-05
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$ 95.00 2022-06-05
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$ 320.00 2022-06-05
A2B Chem LLC
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A2B Chem LLC
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A2B Chem LLC
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A2B Chem LLC
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A2B Chem LLC
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A2B Chem LLC
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A2B Chem LLC
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