Cas no 36448-60-9 (2-methyl-1-thien-2-ylpropan-1-one)

2-Methyl-1-thien-2-ylpropan-1-one is a specialized organic compound featuring a thiophene ring linked to a ketone functional group with a methyl-substituted propane backbone. This structure imparts unique reactivity, making it valuable as an intermediate in organic synthesis, particularly in the preparation of heterocyclic compounds and pharmaceuticals. Its thiophene moiety enhances electronic properties, potentially useful in materials science applications. The compound's well-defined molecular architecture allows for precise modifications, facilitating its use in targeted chemical transformations. It is typically handled under controlled conditions due to its reactivity, and purity is critical for consistent performance in synthetic workflows. Suitable for research and industrial applications requiring tailored ketone derivatives.
2-methyl-1-thien-2-ylpropan-1-one structure
36448-60-9 structure
Product Name:2-methyl-1-thien-2-ylpropan-1-one
CAS No:36448-60-9
MF:C8H10OS
MW:154.229401111603
MDL:MFCD01923419
CID:853773
PubChem ID:3862480
Update Time:2025-06-09

2-methyl-1-thien-2-ylpropan-1-one Chemical and Physical Properties

Names and Identifiers

    • 2-methyl-1-thiophen-2-yl-propan-1-one
    • 2-methyl-1-(2-thienyl)propan-1-one(SALTDATA: FREE)
    • 2-methyl-1-thien-2-ylpropan-1-one
    • 2-methyl-1-thiophen-2-ylpropan-1-one
    • 2-isobutyrylthiophene
    • isopropyl 2-thienyl ketone
    • 2-methyl-1-(2-thienyl)propan-1-one
    • 2-Methyl-1-(2-thienyl)-1-propanone
    • MFCD01923419
    • CS-0234223
    • STK348661
    • SCHEMBL619898
    • G42532
    • EN300-13974
    • 36448-60-9
    • AKOS001127824
    • HMS1736K08
    • BBL039465
    • 2-methyl-1-(thiophen-2-yl)-propan-1-one
    • OTQCCAKDOPROBT-UHFFFAOYSA-N
    • 2-methyl-1-(thiophen-2-yl)propan-1-one
    • DTXSID80397521
    • MDL: MFCD01923419
    • Inchi: 1S/C8H10OS/c1-6(2)8(9)7-4-3-5-10-7/h3-6H,1-2H3
    • InChI Key: OTQCCAKDOPROBT-UHFFFAOYSA-N
    • SMILES: S1C=CC=C1C(C(C)C)=O

Computed Properties

  • Exact Mass: 154.04500
  • Monoisotopic Mass: 154.045
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 131
  • 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: 2.3
  • Topological Polar Surface Area: 45.3?2

Experimental Properties

  • Density: 1.1070
  • Boiling Point: 247.62°C (rough estimate)
  • Flash Point: 97.7°C
  • Refractive Index: 1.5405 (estimate)
  • PSA: 45.31000
  • LogP: 2.58680

2-methyl-1-thien-2-ylpropan-1-one Customs Data

  • HS CODE:2934999090
  • Customs Data:

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2-methyl-1-thien-2-ylpropan-1-one Pricemore >>

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