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ChemicalBook--->CAS DataBase List--->39755-95-8

39755-95-8

39755-95-8 Structure

39755-95-8 Structure
IdentificationMore
[Name]

5-Methoxyisatin
[CAS]

39755-95-8
[Synonyms]

5-METHOXY-2,3-INDOLINEDIONE
5-METHOXYINDOLE-2,3-DIONE
5-METHOXYISATIN
AKOS AU36-M122
5-methoxy-1h-indole-2,3-dione
5-methoxy-1h-indole-3-dione
5-methoxy-indole-3-dione
5-Methoxyisatin,98%
5-Methoxy-2H-indole-2,3(1H)-dione
[EINECS(EC#)]

670-372-2
[Molecular Formula]

C9H7NO3
[MDL Number]

MFCD00169023
[Molecular Weight]

177.16
[MOL File]

39755-95-8.mol
Chemical PropertiesBack Directory
[Melting point ]

201-203°C
[density ]

1.346±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

9.73±0.20(Predicted)
[color ]

Orange to Amber to Dark red
[Water Solubility ]

Soluble in cold water.
[Detection Methods]

HPLC,NMR
[CAS DataBase Reference]

39755-95-8(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RTECS ]

NL7938000
[HazardClass ]

IRRITANT
[HS Code ]

29339900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Hydrochloric acid-->Acetic acid-->Sodium sulfate-->Hydroxylamine hydrochloride-->p-Anisidine-->Methanesulfonic acid-->Chloral hydrate
[Preparation Products]

6-Methoxy-2-(p-tolyl)quinoline-4-carboxylic acid-->5-Methoxy-3-indazolecarboxylic acid
Hazard InformationBack Directory
[Chemical Properties]

Dark red to brown solid
[Uses]

5-Methoxyisatin is used for Pharmaceutical intermediates, a raw material used in chemical synthesis.
[Definition]

ChEBI: 5-Methoxyisatin is a member of indoles. It has a role as an anticoronaviral agent.
[Preparation]

Using water as solvent, 5-methoxyaniline reacted with chloral hydrate and hydroxylamine hydrochloride at 90 ℃ for 3.5h to obtain p-methoxyisonitrosoacetanilide in 95% yield. After hydrolysis, 5-methoxyisatin was obtained in 88% yield by cyclization at 92℃ with concentrated H2SO4 (75%).
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 42, p. 1344, 1977 DOI: 10.1021/jo00428a016
Spectrum DetailBack Directory
[Spectrum Detail]

5-Methoxyisatin(39755-95-8)MS
5-Methoxyisatin(39755-95-8)IR1
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

5-Methoxyisatin, 98%(39755-95-8)
[TCI AMERICA]

5-Methoxyisatin,>95.0%(T)(39755-95-8)
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