Cas no 75782-75-1 (5-tert-butylthiolan-3-one)

5-tert-butylthiolan-3-one structure
5-tert-butylthiolan-3-one structure
Product Name:5-tert-butylthiolan-3-one
CAS No:75782-75-1
MF:C8H14OS
MW:158.261161327362
CID:1775030
PubChem ID:85996356
Update Time:2025-04-21

5-tert-butylthiolan-3-one Chemical and Physical Properties

Names and Identifiers

    • 3(2H)-Thiophenone, 5-(1,1-dimethylethyl)dihydro-
    • 5-tert-butylthiolan-3-one
    • AKOS026744573
    • EN300-178673
    • 75782-75-1
    • Inchi: 1S/C8H14OS/c1-8(2,3)7-4-6(9)5-10-7/h7H,4-5H2,1-3H3
    • InChI Key: CENNGEFXTBJXQA-UHFFFAOYSA-N
    • SMILES: S1CC(CC1C(C)(C)C)=O

Computed Properties

  • Exact Mass: 158.07662
  • Monoisotopic Mass: 158.07653624g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 146
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.2
  • Topological Polar Surface Area: 42.4?2

Experimental Properties

  • PSA: 17.07

5-tert-butylthiolan-3-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
T117768-10mg
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$ 70.00 2022-06-03
TRC
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$ 230.00 2022-06-03
TRC
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$ 340.00 2022-06-03
Enamine
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$229.0 2023-09-19
Enamine
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$342.0 2023-09-19
Enamine
EN300-178673-0.25g
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$487.0 2023-09-19
Enamine
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Enamine
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$0.0 2023-06-08
Enamine
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Enamine
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