Cas no 77358-26-0 (5-methyl-1,2-oxazole-3-carbothioamide)

5-methyl-1,2-oxazole-3-carbothioamide structure
77358-26-0 structure
Product Name:5-methyl-1,2-oxazole-3-carbothioamide
CAS No:77358-26-0
MF:C5H6N2OS
MW:142.178939342499
MDL:MFCD00173804
CID:570139
PubChem ID:2799530
Update Time:2025-04-19

5-methyl-1,2-oxazole-3-carbothioamide Chemical and Physical Properties

Names and Identifiers

    • 3-Isoxazolecarbothioamide,5-methyl-
    • 5-methyl-1,2-oxazole-3-carbothioamide
    • 5-Methylisoxazole-3-carbothioamide
    • 5-Methyl-3-isoxazolcarbothioamid
    • 5-Methyl-isoxazol-3-thiocarbonsaeure-amid
    • 5-Methyl-isoxazole-3-carbothioamide
    • 5-methyl-isoxazole-3-carbothioic acid amide
    • 5-methylisoxazole-3-thiocarboxamide
    • 5-Methylthio-3-isoxazolecarboxamide
    • DTXSID70384081
    • CDA35826
    • CS-0280745
    • FT-0620663
    • AKOS006229616
    • EN300-1836218
    • NSC18367
    • FACDYZJWOVXDHC-UHFFFAOYSA-N
    • 77358-26-0
    • MFCD00173804
    • NSC-18367
    • SCHEMBL3550338
    • STR07527
    • DB-056210
    • MDL: MFCD00173804
    • Inchi: 1S/C5H6N2OS/c1-3-2-4(5(6)9)7-8-3/h2H,1H3,(H2,6,9)
    • InChI Key: FACDYZJWOVXDHC-UHFFFAOYSA-N
    • SMILES: S=C(C1C=C(C)ON=1)N

Computed Properties

  • Exact Mass: 142.02000
  • Monoisotopic Mass: 142.02
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 128
  • 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: 0.6
  • Topological Polar Surface Area: 84.1A^2

Experimental Properties

  • Density: 1.312
  • Melting Point: 169 °C
  • Boiling Point: 305 oC
  • Flash Point: 139 oC
  • Refractive Index: 1.612
  • PSA: 84.14000
  • LogP: 1.31750

5-methyl-1,2-oxazole-3-carbothioamide Security Information

  • Hazard Statement: Irritant
  • Safety Instruction: S24/25
  • Hazardous Material Identification: Xi
  • Safety Term:S24/25

5-methyl-1,2-oxazole-3-carbothioamide 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%

5-methyl-1,2-oxazole-3-carbothioamide Pricemore >>

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