CAS 4274-38-8

Benzenethiol, 2-amino-4-(trifluoromethyl)-, hydrochloride (1:1)

Description:

Benzenethiol, 2-amino-4-(trifluoromethyl)-, hydrochloride (1:1), with the CAS number 4274-38-8, is an organic compound characterized by the presence of a thiol group (-SH) and an amino group (-NH2) attached to a benzene ring, along with a trifluoromethyl group (-CF3) that significantly influences its chemical properties. This compound exists as a hydrochloride salt, indicating that it is typically encountered in a protonated form, which enhances its solubility in water. The trifluoromethyl group contributes to the compound's lipophilicity and can affect its reactivity and biological activity. Benzenethiol derivatives are known for their applications in organic synthesis, pharmaceuticals, and as intermediates in various chemical reactions. The presence of both the amino and thiol functionalities allows for diverse reactivity, including nucleophilic substitution and potential interactions with biological targets. Overall, this compound's unique structure and functional groups make it of interest in both synthetic and medicinal chemistry.

Formula: C₇H₆F₃NS·ClH

InChI: InChI=1S/C7H6F3NS.ClH/c8-7(9,10)4-1-2-6(12)5(11)3-4;/h1-3,12H,11H2;1H

InChI key: InChIKey=FIAGYDIJZOWVAB-UHFFFAOYSA-N

SMILES: C(F)(F)(F)C1=CC(N)=C(S)C=C1.Cl

Synonyms:

• Benzenethiol, 2-amino-4-(trifluoromethyl)-, hydrochloride
• 3-Amino-4-mercaptobenzotrifluoride hydrochloride
• 2-Amino-4-trifluoromethylthiophenol hydrochloride
• 4-Trifluoromethyl-2-aminothiophenol hydrochloride
• p-Toluenethiol, 2-amino-α,α,α-trifluoro-, hydrochloride
• Benzenethiol, 2-amino-4-(trifluoromethyl)-, hydrochloride (1:1)

2-Amino-4-(trifluoromethyl)thiophenol hydrochloride, 97%

CAS: 4274-38-8

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Sci

Formula: C₇H₆F₃NS•HCl

Purity: 97%

Color and Shape: White to cream to yellow or grey, Powder or crystalline powder or lumps

Molecular weight: 229.65

Ref: 02-L09683

2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride

CAS: 4274-38-8

Formula: C₇H₇ClF₃NS

Purity: 95%

Color and Shape: Solid

Molecular weight: 229.6504

Ref: IN-DA0071OG

2-Amino-4-(trifluoromethyl)thiophenol hydrochloride

CAS: 4274-38-8

2-Amino-4-(trifluoromethyl)thiophenol hydrochloride

Purity: 98%

Color and Shape: White Powder

Molecular weight: 229.65g/mol

Ref: 54-PC1077

2-Amino-4-(trifluoromethyl)benzenethiol Hydrochloride

Controlled Product

CAS: 4274-38-8

Applications 2-Amino-4-(trifluoromethyl)benzenethiol Hydrochloride can be used as reactant/reagent in preparation of fused benzo-diazepinones/oxazocinone/thiazapines/diazapines/diazocins/thiazine/indoles via CuI-L-proline catalyzed SN2 reaction.
References Srinivasulu, V., et al.: Tetrahedron, 73, 2139 (2017)

Formula: C₇H₆F₃NS·HCl

Color and Shape: Neat

Molecular weight: 229.65

Ref: TR-A629330

3-Amino-4-mercaptobenzotrifluoride hydrochloride

CAS: 4274-38-8

Formula: C₇H₇ClF₃NS

Purity: 98.0%

Color and Shape: Solid

Molecular weight: 229.65

Ref: 10-F003997