Cas no 628-29-5 (butyl methyl sulphide)

butyl methyl sulphide structure
butyl methyl sulphide structure
Product Name:butyl methyl sulphide
CAS No:628-29-5
MF:C5H12S
MW:104.213780403137
MDL:MFCD00015256
CID:39247
PubChem ID:87563730
Update Time:2025-04-18

butyl methyl sulphide Chemical and Physical Properties

Names and Identifiers

    • butyl methyl sulphide
    • n-Butyl methyl sulphide
    • Butylmethylsulfide
    • Methyl n-butyl sulphide
    • n-Butyl methyl sulfide
    • 1-methylsulfanylbutane
    • METHY BUTYL SULFIDE
    • Methyl-n-butylsulfide
    • Methyl-n-butylsulfideneat
    • 2-thiahexane
    • butyl methyl sulfide
    • MDL: MFCD00015256
    • Inchi: 1S/C5H12S/c1-3-4-5-6-2/h3-5H2,1-2H3
    • InChI Key: WCXXISMIJBRDQK-UHFFFAOYSA-N
    • SMILES: CCCCSC
    • BRN: 1730959

Computed Properties

  • Exact Mass: 104.06600
  • Monoisotopic Mass: 104.065971
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 6
  • Rotatable Bond Count: 3
  • Complexity: 19.9
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.1
  • Topological Polar Surface Area: 25.3

Experimental Properties

  • Color/Form: Colorless liquid
  • Density: 0,85 g/cm3
  • Melting Point: -97.85°C
  • Boiling Point: 123°C
  • Flash Point: 20°C
  • Refractive Index: 1.4621
  • PSA: 25.30000
  • LogP: 2.14950
  • Solubility: Insoluble in water.

butyl methyl sulphide Security Information

butyl methyl sulphide Customs Data

  • HS CODE:2930909090
  • Customs Data:

    China Customs Code:

    2930909090

    Overview:

    2930909090. Other organic sulfur compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

butyl methyl sulphide Pricemore >>

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