Cas no 16452-09-8 (2-(para-Tolylthio)aniline)

2-(para-Tolylthio)aniline is a sulfur-containing aromatic amine with the molecular formula C??H??NS. This compound features a thioether linkage between a para-substituted toluene group and an aniline moiety, making it a versatile intermediate in organic synthesis. Its structure allows for further functionalization, enabling applications in pharmaceuticals, agrochemicals, and materials science. The electron-rich aniline group facilitates electrophilic substitution reactions, while the para-tolylthio moiety enhances stability and influences reactivity. This compound is particularly useful in the synthesis of heterocycles and as a building block for ligands or catalysts. High purity grades ensure consistent performance in research and industrial processes. Proper handling is advised due to potential sensitivity to air and moisture.
2-(para-Tolylthio)aniline structure
2-(para-Tolylthio)aniline structure
Product Name:2-(para-Tolylthio)aniline
CAS No:16452-09-8
MF:C13H13NS
MW:215.31402182579
CID:148033
PubChem ID:140075
Update Time:2025-06-09

2-(para-Tolylthio)aniline Chemical and Physical Properties

Names and Identifiers

    • Benzenamine,2-[(4-methylphenyl)thio]-
    • 2-(4-methylphenyl)sulfanylaniline
    • Benzenamine, 2-((4-methylphenyl)thio)-
    • 2-amino-4'-methyldiphenyl sulphide
    • 2-aminophenyl p-tolyl sulfide
    • 2NH2Ph-S-4MePh
    • 2-p-Tolylmercapto-anilin
    • 2-p-tolylsulfanyl-aniline
    • 2-(p-Tolylthio)aniline
    • 2-((4-Methylphenyl)thio)aniline hydrochloride
    • DTXSID70167775
    • NSC 136939
    • NSC632997
    • AKOS000215481
    • CS-0284214
    • 2-[(4-methylphenyl)sulfanyl]aniline
    • 2-(p-tolylsulfanyl)aniline
    • NSC136939
    • FT-0729577
    • NSC-136939
    • Benzenamine, 2-[(4-methylphenyl)thio]-
    • 16452-09-8
    • EN300-7549136
    • SCHEMBL546833
    • 2-Aminophenyl 4-methylphenyl sulfide
    • NCI60_010905
    • CHEMBL2007934
    • 2-(PARA-TOLYLTHIO)-ANILINE
    • 2-(para-Tolylthio)aniline
    • Inchi: 1S/C13H13NS/c1-10-6-8-11(9-7-10)15-13-5-3-2-4-12(13)14/h2-9H,14H2,1H3
    • InChI Key: KGFFMVMQCXIUOX-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=CC=1N)C1C=CC(C)=CC=1

Computed Properties

  • Exact Mass: 215.07700
  • Monoisotopic Mass: 215.07687
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 187
  • 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
  • Topological Polar Surface Area: 51.3
  • XLogP3: 3.7

Experimental Properties

  • Density: 1.17
  • Boiling Point: 349.9°Cat760mmHg
  • Flash Point: 165.4°C
  • Refractive Index: 1.658
  • PSA: 51.32000
  • LogP: 4.30960

2-(para-Tolylthio)aniline 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%

2-(para-Tolylthio)aniline Pricemore >>

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