2-((2,4-DiMethylphenyl)thio)phenylaMine
- Product Name
- 2-((2,4-DiMethylphenyl)thio)phenylaMine
- CAS No.
- 1019453-85-0
- Chemical Name
- 2-((2,4-DiMethylphenyl)thio)phenylaMine
- Synonyms
- VOR-IM D;VOR-IM B;Vortioxetine Impurity 89;Vortioxetine Impurity 60;2-((2,4-dimethylphenyl)thio)aniline;2-((2,4-DiMethylphenyl)thio)phenylaMine;2-[(2,4-diMethylphenyl)thio]-BenzenaMine;Benzenamine, 2-[(2,4-dimethylphenyl)thio]-;(2,4-Dimethylphenyl) (2-aminophenyl)sulfide;Wortioxetine intermediate: 2-((2,4-dimethylphenyl) thio) aniline
- CBNumber
- CB82716983
- Molecular Formula
- C14H15NS
- Formula Weight
- 229.34
- MOL File
- 1019453-85-0.mol
2-((2,4-DiMethylphenyl)thio)phenylaMine Property
- Boiling point:
- 341.3±30.0 °C(Predicted)
- Density
- 1.14±0.1 g/cm3(Predicted)
- storage temp.
- under inert gas (nitrogen or Argon) at 2–8 °C
- solubility
- DMSO (Sparingly), Methanol (Sparingly)
- pka
- 3.12±0.10(Predicted)
- form
- Oil to Semi-Solid
- color
- Dark Brown to Very Dark Red
- Stability:
- Hygroscopic
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
- Precautionary statements
-
P280Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- D447335
- Product name
- 2-[(2,4-Dimethylphenyl)sulfanyl]aniline
- Packaging
- 50mg
- Price
- $45
- Updated
- 2021/12/16
- Product number
- 93282
- Product name
- 2-[(2,4-Dimethylphenyl)sulfanyl]aniline
- Packaging
- 50mg
- Price
- $345
- Updated
- 2021/12/16
- Product number
- 0526DD
- Product name
- 2-((2,4-Dimethylphenyl)thio)aniline
- Packaging
- 25g
- Price
- $508
- Updated
- 2021/12/16
- Product number
- A400978
- Product name
- 2-((2,4-Dimethylphenyl)thio)aniline
- Purity
- 97%
- Packaging
- 1g
- Price
- $29
- Updated
- 2021/12/16
- Product number
- A400978
- Product name
- 2-((2,4-Dimethylphenyl)thio)aniline
- Purity
- 97%
- Packaging
- 5g
- Price
- $100
- Updated
- 2021/12/16
2-((2,4-DiMethylphenyl)thio)phenylaMine Chemical Properties,Usage,Production
Uses
2-[(2,4-Dimethylphenyl)sulfanyl]aniline is used in the study of N-O-glucuronide metabolites of Lu AA21004 (Vortioxetine [V766000]), an antidepressant.
Synthesis
4214-28-2
137-07-5
1019453-85-0
Using 4-iodo-m- dimethylbenzene (1.43 mL, 10.0 mmol) and 2-aminothiophenol (1.07 mL, 10.0 mmol) as raw materials, the above raw materials were mixed with cuprous iodide (0.19 g, 1.0 mmol), potassium carbonate (6.90 g, 50.0 mmol) and dried and degassed dimethylsulfoxide (50 mL) under nitrogen protection at 120 °C for 16 h with stirring. After completion of the reaction, the mixture was cooled to room temperature, diluted with water (50 mL) and the product was extracted with ethyl acetate (2 x 150 mL). The organic layers were combined and washed sequentially with water (3 x 150 mL) and brine (3 x 150 mL). The organic phase was dried over anhydrous magnesium sulfate and the solvent was concentrated under reduced pressure to afford 2-((2,4-dimethylphenyl)thio)aniline as a dark colored oil (2.15 g, 94% yield). The structure of the product was confirmed by nuclear magnetic resonance hydrogen spectroscopy (1H NMR, CDCl3, 500 MHz) and mass spectrometry (ESI): 1H NMR δ 2.28 (s, 3H), 2.40 (s, 3H), 4.24 (br s, 2H), 6.71 (d, J = 8.1 Hz, 1H), 6.75-6.81 (m, 2H), 6.87 (m, 1H) 7.02 (m, 1H), 7.23 (m, 1H), 7.38 (dd, J = 1.5, 7.7 Hz, 1H); MS (ESI) m/z: 230 [MH]+.
References
[1] Patent: WO2015/155153, 2015, A1. Location in patent: Page/Page column 15
2-((2,4-DiMethylphenyl)thio)phenylaMine Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 2-((2,4-DiMethylphenyl)thio)phenylaMine manufacturers
- Product
- 2-((2,4-Dimethylphenyl)thio)aniline 1019453-85-0
- Price
- US $0.00-0.00/kg
- Min. Order
- 1kg
- Purity
- 99%
- Supply Ability
- 1
- Release date
- 2025-08-26
- Product
- 2-((2,4-DiMethylphenyl)thio)phenylaMine 1019453-85-0
- Price
- US $6.60/KG
- Min. Order
- 1KG
- Purity
- 97%-99%
- Supply Ability
- 1kg-1000kg
- Release date
- 2019-12-30