4-(Trifluoromethyl)thiobenzamide

Product Name: 4-(Trifluoromethyl)thiobenzamide
CAS No.: 72505-21-6
Chemical Name: 4-(Trifluoromethyl)thiobenzamide
Synonyms: BUTTPARK 43\57-98;p-TrifuoromethylThioBenzamide;4-(Trifluoromethyl)thiobenzami;4-TRIFUOROMETHYL THIOBENZAMIDE;4-(TRIFLUOROMETHYL)THIOBENZAMIDE;p-(Trifluoromethyl)thiobenzamide;4-(trifluoromethyl)thiobenzamine;4-(trifluoromethyl)benzothioamide;4-(Trifluoromethyl)thiobenzamide98%;4- threetrifluoroMethylthiobenzaMide
CBNumber: CB8338598
Molecular Formula: C8H6F3NS
Formula Weight: 205.2
MOL File: 72505-21-6.mol

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4-(Trifluoromethyl)thiobenzamide Property

Melting point:: 136-137 °C
Boiling point:: 246.0±50.0 °C(Predicted)
Density: 1.372±0.06 g/cm3(Predicted)
storage temp.: Sealed in dry,2-8°C
pka: 12.04±0.29(Predicted)
form: powder to crystal
color: Light yellow to Yellow to Green
Sensitive: Stench
BRN: 4672885
InChI: InChI=1S/C8H6F3NS/c9-8(10,11)6-3-1-5(2-4-6)7(12)13/h1-4H,(H2,12,13)
InChIKey: IPRFNMJROWWFBH-UHFFFAOYSA-N
SMILES: C1(C(N)=S)=CC=C(C(F)(F)F)C=C1
CAS DataBase Reference: 72505-21-6(CAS DataBase Reference)
NIST Chemistry Reference: 4-(Trifluoromethyl)thiobenzamide(72505-21-6)

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Safety

Hazard Codes: Xn,Xi,T
Risk Statements: 20/21/22-36/37/38
Safety Statements: 36/37/39-26-22-36
RIDADR: 2811
Hazard Note: Irritant/Stench
HazardClass: 6.1
PackingGroup: III
HS Code: 29309090

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Danger

Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H331Toxic if inhaled

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P405Store locked up.

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N-Bromosuccinimide Price

TCI Chemical

Product number: T2771
Product name: 4-(Trifluoromethyl)thiobenzamide
Purity: >98.0%(HPLC)
Packaging: 5g
Price: $40
Updated: 2025/07/31

TCI Chemical

Product number: T2771
Product name: 4-(Trifluoromethyl)thiobenzamide
Purity: >98.0%(HPLC)
Packaging: 25g
Price: $158
Updated: 2025/07/31

TRC

Product number: T896405
Product name: 4-(Trifluoromethyl)thiobenzamide
Packaging: 5g
Price: $60
Updated: 2021/12/16

Apolloscientific

Product number: PC7769F
Product name: 4-(Trifluoromethyl)thiobenzamide
Purity: 98%
Packaging: 100g
Price: $85
Updated: 2021/12/16

Matrix Scientific

Product number: 007667
Product name: 4-(Trifluoromethyl)thiobenzamide
Purity: 97%
Packaging: 100g
Price: $112
Updated: 2021/12/16

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4-(Trifluoromethyl)thiobenzamide Chemical Properties,Usage,Production

Chemical Properties

Yellow crystalline powder

Synthesis

455-18-5

72505-21-6

The general procedure for the synthesis of 4-(trifluoromethyl)thiobenzamide from 4-trifluoromethylbenzonitrile was as follows: 500 mg (2.92 mmol) of 4-trifluoromethylbenzonitrile was reacted with 702 mg (8.7 mmol) of sodium thiohydride for 3 hr at 60 °C. Ethanol was used as a solvent during the reaction, and the ethanol was removed by distillation after the reaction was completed. Subsequently, ethyl acetate was added to the reaction mixture and the resulting solution was washed with water. The organic layer was dried with anhydrous magnesium sulfate and then the solvent was removed by distillation. The residue was purified by column chromatography to give 517 mg (95% yield) of 4-(trifluoromethyl)thiobenzamide. The product could be used in the next step of the reaction without further purification. Mass spectrometry (EI) showed a molecular ion peak of 152 (M++1).

References

[1] Journal of Medicinal Chemistry, 2014, vol. 57, # 8, p. 3213 - 3222
[2] Patent: WO2005/40127, 2005, A1. Location in patent: Page/Page column 100-101
[3] Journal of Fluorine Chemistry, 2006, vol. 127, # 1, p. 63 - 67
[4] Patent: WO2004/6922, 2004, A1. Location in patent: Page/Page column 27; 28
[5] RSC Advances, 2018, vol. 8, # 1, p. 170 - 175

4-(Trifluoromethyl)thiobenzamide Preparation Products And Raw materials

Raw materials

Preparation Products

2-[4-(TRIFLUOROMETHYL)PHENYL]-1,3-THIAZOLE-4-CARBALDEHYDE 4-METHYL-2-[4-(TRIFLUOROMETHYL)PHENYL]-1,3-THIAZOLE-5-CARBALDEHYDE

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4-(Trifluoromethyl)thiobenzamide Suppliers

Belgium 2 China 151 Europe 3 France 1 Germany 6 India 5 Italy 1 Japan 1 Slovakia 1 Ukraine 2 United Kingdom 16 United States 24 Global 213

Aaron Chemistry GmbH

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ratiochem GmbH

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Service Chemical Inc.

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ABCR GmbH & CO. KG

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Lanxess Deutschland GmbH

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Aaron Chemistry GmbH

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ProdList: 137
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View Lastest Price from 4-(Trifluoromethyl)thiobenzamide manufacturers

Career Henan Chemical Co

Product: 4-(Trifluoromethyl)thiobenzamide 72505-21-6
Price: US $8.00/kg
Min. Order: 1kg
Purity: 99%
Supply Ability: 10tons
Release date: 2018-12-24

72505-21-6, 4-(Trifluoromethyl)thiobenzamideRelated Search:

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p-(Trifluoromethyl)thiobenzamide

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4-(Trifluoromethyl)thiobenzamide, 98%min

72505-21-6

C8H6F3NS

C8H6NF3S

Phenyls & Phenyl-Het

Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts

Phenyls & Phenyl-Het