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    CAS 641571-11-1
    Also known as: 641571-11-1, 3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)aniline, Benzenamine, 3-(4-methyl-1h-imidazol-1-yl)-5-(trifluoromethyl)-, 3-(4-methyl-1h-imidazol-1-yl)-5-trifluoromethylaniline, 5lli0q7app, 1-(3-amino-5-trifluoromethylphenyl)-4-methylimidazole
    Molecular Formula
    C11H10F3N3
    Molecular Weight
    241.21  g/mol
    InChI Key
    WWTGXYAJVXKEKL-UHFFFAOYSA-N
    FDA UNII
    5LLI0Q7APP
    1 2D Structure

    CAS 641571-11-1

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)aniline
    2.1.2 InChI
    InChI=1S/C11H10F3N3/c1-7-5-17(6-16-7)10-3-8(11(12,13)14)2-9(15)4-10/h2-6H,15H2,1H3
    2.1.3 InChI Key
    WWTGXYAJVXKEKL-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=CN(C=N1)C2=CC(=CC(=C2)N)C(F)(F)F
    2.2 Other Identifiers
    2.2.1 UNII
    5LLI0Q7APP
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 641571-11-1

    2. 3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)aniline

    3. Benzenamine, 3-(4-methyl-1h-imidazol-1-yl)-5-(trifluoromethyl)-

    4. 3-(4-methyl-1h-imidazol-1-yl)-5-trifluoromethylaniline

    5. 5lli0q7app

    6. 1-(3-amino-5-trifluoromethylphenyl)-4-methylimidazole

    7. Mfcd11846236

    8. 3-(4-methyl-1-imidazolyl)-5-(trifluoromethyl)aniline

    9. 3-(4-methyl-1h-imidazole-1-yl)-5-(trifluoromethyl)aniline

    10. 3-(4-methyl-1h-imidazol-1-yl)-5-(trifluoromethyl)benzenamine

    11. 3-(trifluoromethyl)-5-(4-methyl-1h-imidazol-1-yl)benzenamine

    12. Nilotinib Impurity A

    13. Unii-5lli0q7app

    14. Ec 688-269-6

    15. Schembl589390

    16. Schembl1505804

    17. Dtxsid10475604

    18. Bcp04529

    19. Zinc84397771

    20. Akos015842181

    21. Ac-8508

    22. Cs-w019667

    23. Gs-4414

    24. Mb10071

    25. Sy015266

    26. A8805

    27. Am20090650

    28. Ft-0655008

    29. M2634

    30. Nilotinib Related Compound A [usp-rs]

    31. 571m111

    32. Q-101351

    33. 1-[3-amino-5-(trifluoromethyl)phenyl]-4-methylimidazole

    34. 3-(4-methylimidazol-1-yl)-5-trifluoromethyl-phenylamine

    35. 3-(4-methylimidazol-1-yl)-5-trifluoromethylphenylamine

    36. 3-(4-methyl-1h-imidazol-1yl)-5-(trifluoromethyl)aniline

    37. 3-(4-methyl-1h-imidazol-1-yl)-5-(trifluoromethyl) Aniline ?

    38. 3-(4-methyl-1h-imidazol-1-yl)-5-(trifluoromethyl)-benzenamine

    39. 3-(4-methyl-1h-imidazol-1-yl)-5-(trifluoromethyl)benzeneamine

    40. 5-(4-methyl-1h-imidazol-1-yl)-3-(trifluoromethyl)-benzenamine

    41. 5-(4-methyl-1h-imidazol-1-yl)-3-trifluoromethyl-phenylamine

    42. 3-(4-methyl-imidazol-1-yl)-5-trifluoromethyl-phenylamine

    43. Nilotinib Hydrochloride Monohydrate Impurity A [ep Impurity]

    44. Benzenamine, 3-(4-methyl-1h-imidazol-1-yl)-5-(trifluoromethyl)

    2.4 Create Date
    2007-02-05
    3 Chemical and Physical Properties
    Molecular Weight 241.21 g/mol
    Molecular Formula C11H10F3N3
    XLogP32.3
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count1
    Exact Mass241.08268182 g/mol
    Monoisotopic Mass241.08268182 g/mol
    Topological Polar Surface Area43.8 Ų
    Heavy Atom Count17
    Formal Charge0
    Complexity269
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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                                      Tivan Sciences

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                                        4-Methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzo...

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                                        641569-94-0
                                        Nilotinib
                                        Tivan Sciences is an API manufacturing company founded in January 2020 and located in Rajkot, Gujarat. Th...
                                        Tivan Sciences is an API manufacturing company founded in January 2020 and located in Rajkot, Gujarat. The company is committed to developing high-quality products through robust in-house R&D which allows them to constantly innovate and create new products that meet the needs of the market. They have team expertise in organic chemistry, analytical chemistry, and chemical engineering. Additionally, they use state-of-the-art equipment and follow industry-standard procedures to ensure consistency and quality in our products.
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                                          3-[(Aminoiminomethyl)amino]-4-methyl benzoic acid ethyl...

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                                          641569-96-2
                                          Nilotinib
                                          Tivan Sciences is an API manufacturing company founded in January 2020 and located in Rajkot, Gujarat. Th...
                                          Tivan Sciences is an API manufacturing company founded in January 2020 and located in Rajkot, Gujarat. The company is committed to developing high-quality products through robust in-house R&D which allows them to constantly innovate and create new products that meet the needs of the market. They have team expertise in organic chemistry, analytical chemistry, and chemical engineering. Additionally, they use state-of-the-art equipment and follow industry-standard procedures to ensure consistency and quality in our products.
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                                            3-(dimethylamino)-1-(3-pyridinyl)-2-propen-1-one

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                                            55314-16-4
                                            Nilotinib
                                            Tivan Sciences is an API manufacturing company founded in January 2020 and located in Rajkot, Gujarat. Th...
                                            Tivan Sciences is an API manufacturing company founded in January 2020 and located in Rajkot, Gujarat. The company is committed to developing high-quality products through robust in-house R&D which allows them to constantly innovate and create new products that meet the needs of the market. They have team expertise in organic chemistry, analytical chemistry, and chemical engineering. Additionally, they use state-of-the-art equipment and follow industry-standard procedures to ensure consistency and quality in our products.
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                                            Zhejiang Huahai Pharmaceutical Co.,...

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                                            trans-4-(4-Fluorophenyl)-3-(hydroxymethyl)-1-methylpipe...

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                                            109887-53-8
                                            Paroxetine Hydrochloride
                                            Zhejiang Huahai Pharmaceuticals Co., Ltd.was initially founded in 1989, and the company's stock was succe...
                                            Zhejiang Huahai Pharmaceuticals Co., Ltd.was initially founded in 1989, and the company's stock was successfully listed in Shanghai Stock Exchange in March, 2003. Huahai Pharmaceuticals, a large scaled modern pharmaceutical group that integrates fomulations, APIs(Active Pharmaceutical Ingredients) and intermediates, is developing both domestic and international markets, and performing parallel development of science, industry and commerce. With a total asset of 1,900 million yuan, the company has 11branches (subsidiaries) in the United States, Shanghai, Hangzhou, and Linhai.
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                                            (3S,4R)-4-(4-fluorophenyl)-3-(3,4-methylenedioxyphenoxy...

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                                            110429-36-2
                                            Paroxetine Hydrochloride
                                            Zhejiang Huahai Pharmaceuticals Co., Ltd.was initially founded in 1989, and the company's stock was succe...
                                            Zhejiang Huahai Pharmaceuticals Co., Ltd.was initially founded in 1989, and the company's stock was successfully listed in Shanghai Stock Exchange in March, 2003. Huahai Pharmaceuticals, a large scaled modern pharmaceutical group that integrates fomulations, APIs(Active Pharmaceutical Ingredients) and intermediates, is developing both domestic and international markets, and performing parallel development of science, industry and commerce. With a total asset of 1,900 million yuan, the company has 11branches (subsidiaries) in the United States, Shanghai, Hangzhou, and Linhai.
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                                            Zhejiang Huahai Pharmaceutical Co.,...

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                                            (3S,4R)-3-hydroxymethyl-4-(4'-fluorophenyl)-N-methylpip...

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                                            105812-81-5
                                            Paroxetine Hydrochloride
                                            Zhejiang Huahai Pharmaceuticals Co., Ltd.was initially founded in 1989, and the company's stock was succe...
                                            Zhejiang Huahai Pharmaceuticals Co., Ltd.was initially founded in 1989, and the company's stock was successfully listed in Shanghai Stock Exchange in March, 2003. Huahai Pharmaceuticals, a large scaled modern pharmaceutical group that integrates fomulations, APIs(Active Pharmaceutical Ingredients) and intermediates, is developing both domestic and international markets, and performing parallel development of science, industry and commerce. With a total asset of 1,900 million yuan, the company has 11branches (subsidiaries) in the United States, Shanghai, Hangzhou, and Linhai.
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