Cas no 4163-79-5 (2,6-Dimethylthioanisole)

2,6-Dimethylthioanisole structure
2,6-Dimethylthioanisole structure
Product Name:2,6-Dimethylthioanisole
CAS No:4163-79-5
MF:C9H12S
MW:152.256581306458
CID:820927
PubChem ID:525338
Update Time:2025-04-19

2,6-Dimethylthioanisole Chemical and Physical Properties

Names and Identifiers

    • 2,6-Dimethylthioanisole
    • 1,3-dimethyl-2-methylsulfanylbenzene
    • (2,6-Dimethyl-phenyl)-methyl-sulfid
    • 1,3-dimethyl-2-(methylthio)benzene
    • 1,3-dimethyl-2-methylsulfanyl-benzene
    • 2,5-DIMETHYL-1-PROPYL-1H-PYRROLE
    • 2,6-dimethylphenyl-methyl-sulfide
    • 2-methylthio-1,3-xylene
    • methyl-(2,6-dimethylphenyl)sulfide
    • MDL: MFCD03789165
    • Inchi: 1S/C9H12S/c1-7-5-4-6-8(2)9(7)10-3/h4-6H,1-3H3
    • InChI Key: ITVXUDPAZIIEKD-UHFFFAOYSA-N
    • SMILES: S(C)C1C(C)=CC=CC=1C

Computed Properties

  • Exact Mass: 152.06600
  • Monoisotopic Mass: 152.06597156g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 90.9
  • 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
  • XLogP3: 3.2
  • Topological Polar Surface Area: 25.3?2

Experimental Properties

  • Density: 0.99
  • Boiling Point: 201.9°C at 760 mmHg
  • Flash Point: 74.9°C
  • Refractive Index: 1.551
  • PSA: 25.30000
  • LogP: 3.02530
  • Vapor Pressure: 0.4±0.4 mmHg at 25°C

2,6-Dimethylthioanisole Security Information

2,6-Dimethylthioanisole 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%

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