Cas no 369-68-6 (3-(Trifluoromethylthio)aniline)

3-(Trifluoromethylthio)aniline is a fluorinated aromatic amine featuring a trifluoromethylthio (–SCF?) substituent. This compound is valued for its electron-withdrawing properties and stability, making it a versatile intermediate in organic synthesis, particularly in pharmaceuticals and agrochemicals. The –SCF? group enhances lipophilicity and metabolic resistance, contributing to improved bioavailability in active compounds. Its reactivity allows for further functionalization, such as diazotization or coupling reactions, enabling the synthesis of complex derivatives. The compound is typically handled under inert conditions due to its sensitivity to oxidation. Its unique structural features make it a valuable building block for designing advanced materials and bioactive molecules.
3-(Trifluoromethylthio)aniline structure
369-68-6 structure
Product Name:3-(Trifluoromethylthio)aniline
CAS No:369-68-6
MF:C7H6F3NS
MW:193.189450740814
MDL:MFCD00190130
CID:82213
PubChem ID:2735939
Update Time:2025-06-22

3-(Trifluoromethylthio)aniline Chemical and Physical Properties

Names and Identifiers

    • 3-(Trifluoromethylthio)aniline
    • 3-(trifluoromethylsulfanyl)aniline
    • 3-[(trifluoromethyl)thio]Benzenamine
    • 3-Aminophenyl trifluoromethyl sulfide
    • 369-68-6
    • Benzenamine, 3-[(trifluoromethyl)thio]-
    • DTXSID9073171
    • A823487
    • SCHEMBL656796
    • EN300-127292
    • TS-00269
    • 3-Aminophenyl trifluoromethyl sulphide
    • MFCD00190130
    • 3-[(trifluoromethyl)sulfanyl]aniline
    • EINECS 206-722-4
    • 3-(trifluoromethylthio) aniline
    • FT-0613961
    • 3-((Trifluoromethyl)thio)aniline
    • NS00041733
    • AMY14285
    • Benzeneamine, 3-[(trifluoromethyl)thio]-
    • AKOS005254400
    • Benzeneamine, 3-((trifluoromethyl)thio)-
    • aniline, 3-trifluoromethylthio-
    • BBL102674
    • STL556478
    • 3- Trifluoromethylthio aniline
    • DB-006348
    • MDL： MFCD00190130
    • Inchi： 1S/C7H6F3NS/c8-7(9,10)12-6-3-1-2-5(11)4-6/h1-4H,11H2
    • InChI Key： DENPAKQJZNDKEL-UHFFFAOYSA-N
    • SMILES： S(C(F)(F)F)C1C=CC=C(C=1)N

Computed Properties

  • Exact Mass: 193.01700
  • Monoisotopic Mass: 193.017
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 148
  • 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: nothing
  • Topological Polar Surface Area: 51.3A^2

Experimental Properties

  • Color/Form: Not available
  • Density: 1,342 g/cm3
  • Boiling Point: 221-224°C
  • Flash Point: 103°C
  • Refractive Index: 1.522
  • Water Partition Coefficient: Immiscible with water.
  • PSA: 51.32000
  • LogP: 3.46190
  • Solubility: Not available

3-(Trifluoromethylthio)aniline Security Information

  • Hazard Statement： Toxic
  • Hazardous Material transportation number：2810
  • Hazard Category Code： 20/21/22-36/37/38
  • Safety Instruction： S23; S36/37/39; S36/37; S26
  • Hazardous Material Identification： T Xn
  • HazardClass：6.1
  • PackingGroup：III
  • Safety Term：6.1
  • Packing Group：III
  • Risk Phrases：R20/21/22
  • Packing Group：III
  • Hazard Level：6.1

3-(Trifluoromethylthio)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%

3-(Trifluoromethylthio)aniline Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI XIAN DING Biotechnology Co., Ltd.
003231-1g
3-(Trifluoromethylthio)aniline
 369-68-6 98%
1g
 421CNY 2021-05-08
Apollo Scientific
PC3714-5g
3-[(Trifluoromethyl)sulphanyl]aniline
 369-68-6 97%
5g
 ￡110.00 2023-09-01
Apollo Scientific
PC3714-25g
3-[(Trifluoromethyl)sulphanyl]aniline
 369-68-6 97%
25g
 ￡300.00 2023-09-01
Chemenu
CM343750-5g
3-(Trifluoromethylthio)aniline
 369-68-6 95%+
5g
 $122 2023-02-02
Chemenu
CM343750-25g
3-(Trifluoromethylthio)aniline
 369-68-6 95%+
25g
 $400 2023-02-02
Chemenu
CM343750-100g
3-(Trifluoromethylthio)aniline
 369-68-6 95%+
100g
 $1200 2023-02-02
SHANG HAI XIAN DING Biotechnology Co., Ltd.
003231-1g
3-(Trifluoromethylthio)aniline
 369-68-6 98%
1g
 421.0CNY 2021-07-13
TRC
T899490-250mg
3-(Trifluoromethylthio)aniline
 369-68-6
250mg
 $ 50.00 2022-06-02
TRC
T899490-500mg
3-(Trifluoromethylthio)aniline
 369-68-6
500mg
 $ 65.00 2022-06-02
TRC
T899490-2.5g
3-(Trifluoromethylthio)aniline
 369-68-6
2.5g
 $ 135.00 2022-06-02

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