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3,4-Dimethylthiophenol | 18800-53-8

Product name:3,4-Dimethylthiophenol

CAS No:18800-53-8
MF:C8H10S
MW:138.2300
MDL:MFCD00010023
CID:51153
PubChem ID:87799
Names and Identifiers
  • 3,4-Dimethylthiophenol
  • 3,4-Dimethylbenzenethiol
  • 3,4-Dimethylthiophenolneat
  • 3,4-Dimethylbenzothiol
  • 3,4-Dimethyl-phenylmercaptan
  • 3-methyl-4-methylthiophenol
  • 4-Mercapto-o-xylene
  • Benzenethiol,3,4-dimethyl
  • EINECS 242-587-8
  • o-Xylene-4-thiol
  • 3,4-DIMETHYLTHIOPHEN
  • 3,4-DIMETHYLTHIOPHENE
  • 3,4-dimethyl-benzenethio
  • 3,4-Dimethyl Thiophenole
  • 3,4-Dimethylthiophenol,98%
  • 3,4-Dimethylthiophenol 98%
  • Benzenethiol, 3,4-dimethyl-
  • 3,4-Dimethyl thiophenol
  • 3,4-dimethylbenzene-1-thiol
  • IDKCKPBAFOIONK-UHFFFAOYSA-N
  • L4F41SS351
  • 3,4-Xylenethiol
  • PubChem6812
  • 3,4-dimethyl-thiophenol
  • 3,4-dimethyl-benzenethiol
  • 3-methyl 4-methylthiophenol
  • 3,4-Dimethylbenzenethiol #
  • 3,4-Dimethylbenzenethi
  • 3,4-dimethylthiophenol
  • O-XYLENE-4-THIOL
  • 4-MERCAPTO-O-XYLENE
  • 3,4-DIMETHYLTHIOPHENOL
  • 3,4-DIMETHYLBENZENETHIOL
  • 3,4-Dimethylbenzenethiol, 98%
  • PS-3445
  • FT-0614371
  • D3344
  • AKOS000120651
  • HMS1783E03
  • 4-Methylthio-M-Cresol
  • A813203
  • MFCD00010023
  • UNII-L4F41SS351
  • EN300-17284
  • 1,3,4,6-TETRA-O-ACETYL-2-AMINO-2-DESOXY-BETA-D-GLUCOPYRANOSEHYDROCHLORIDE
  • NS00026156
  • DTXSID4066418
  • SCHEMBL91378
  • 18800-53-8
  • W-206373
  • MDL:MFCD00010023
  • InChIKey:IDKCKPBAFOIONK-UHFFFAOYSA-N
  • Inchi:1S/C8H10S/c1-6-3-4-8(9)5-7(6)2/h3-5,9H,1-2H3
  • SMILES:S([H])C1C([H])=C([H])C(C([H])([H])[H])=C(C([H])([H])[H])C=1[H]
  • BRN:2040353
Chemical and Physical Properties

Computed Properties

  • Exact Mass: 138.05000
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Rotatable Bond Count: 0
  • Monoisotopic Mass: 138.05
  • Heavy Atom Count: 9
  • Complexity: 90.6
  • Isotope Atom Count: 0
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Covalently-Bonded Unit Count: 1
  • XLogP3: 3.3
  • Tautomer Count: 9
  • Surface Charge: 0
  • Topological Polar Surface Area: 1

Experimental Properties

  • LogP: 2.59210
  • PSA: 38.80000
  • Refractive Index: n20/D 1.5736(lit.)
  • Boiling Point: 218°C(lit.)
  • Melting Point: -30°C (estimate)
  • Flash Point: Fahrenheit: 194 ° f
    Celsius: 90 ° c
  • Color/Form: Uncertain
  • Solubility: Uncertain
  • Density: 1.027 g/mL at 25 °C(lit.)
Security Information
  • Symbol: GHS07
  • WGK Germany:3
  • Safety Term:S26;S36/37/39
  • Safety Instruction:S26-S36/37/39
  • Risk Phrases:R36/37/38
  • Dấu hiệu hàng nguy hiểm: Xi Xi
  • Hazardous Material transportation number:UN 3334
  • Hazard Statement:H315,H319,H335
  • Warning Statement:P261,P305+P351+P338
  • Prompt:warning
  • Hazard Category Code:36/37/38
  • Signal Word:Warning
  • TSCA:T
  • HazardClass:6.1
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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