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74587-12-5

74587-12-5 Structure

74587-12-5 Structure
IdentificationMore
[Name]

3-IODO-4-METHOXYANILINE
[CAS]

74587-12-5
[Synonyms]

3-Iodo-p-anisidine
4-Amino-2-iodoanisole
3-IODO-4-METHOXYANILINE
3-Iodo-4-methoxyaniline>
3-Iodo-4-methoxyaniline,98%
3-Iodo-4-methoxybenzenamine
3-Iodo-4-methoxy-phenylamine
BenzenaMine,3-iodo-4-Methoxy-
4-Amino-2-iodoanisole, 3-Iodo-p-anisidine
(3-iodo-4-methoxyphenyl)amine hydrochloride
4-AMino-2-iodoanisole[3-Iodo-4-Methoxyaniline]
[Molecular Formula]

C7H8INO
[MDL Number]

MFCD06656566
[Molecular Weight]

249.05
[MOL File]

74587-12-5.mol
Chemical PropertiesBack Directory
[Melting point ]

74 °C
[Boiling point ]

321℃
[density ]

1.807
[Fp ]

148℃
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[pka]

4.24±0.10(Predicted)
[color ]

White to Gray to Brown
[InChIKey]

UHPNLGCUIGEZRB-UHFFFAOYSA-N
[CAS DataBase Reference]

74587-12-5(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

2922290090
Spectrum DetailBack Directory
[Spectrum Detail]

3-IODO-4-METHOXYANILINE(74587-12-5)1HNMR
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

3-Iodo-4-methoxyaniline,>98.0%(GC)(T)(74587-12-5)
Hazard InformationBack Directory
[Synthesis]

2-Iodo-4-nitroanisole

5399-03-1

3-IODO-4-METHOXYANILINE

74587-12-5

General procedure for the synthesis of 3-iodo-4-methoxyaniline from 2-iodo-4-nitroanisole: To a 250 mL round-bottomed flask were added 2-iodo-1-methoxy-4-nitrobenzene (6 g, 21.50 mmol, 1.00 eq.), iron powder (3.61 g, 64.50 mmol, 3.00 eq.), ammonium chloride (3.42 g, 63.94 mmol , 3.00 equiv), ethanol (50 mL) and water (10 mL). The reaction mixture was stirred at 85 °C for 1 hour. Upon completion of the reaction, the solid insoluble material was removed by filtration and the filtrate was concentrated under reduced pressure. The brown solid product 3-iodo-4-methoxyaniline (5.35 g, 100% yield) was obtained. The product was analyzed by liquid chromatography-mass spectrometry (LC-MS): (electrospray ionization, m/z) retention time (RT) = 0.847 min, LCMS 53: m/z = 250 [M + 1].

[References]

[1] Patent: WO2018/118842, 2018, A1. Location in patent: Paragraph 0421-0424
[2] Patent: WO2016/199943, 2016, A1. Location in patent: Paragraph 0303
[3] Patent: WO2013/14039, 2013, A1. Location in patent: Page/Page column 45-46
[4] Patent: WO2014/152029, 2014, A2. Location in patent: Paragraph 00230
[5] Journal of the American Chemical Society, 1941, vol. 63, p. 2482,2484
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