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5-Iodoisatin

5-Iodoisatin structure

5-Iodoisatin 

structure
  • CAS No:

    20780-76-1

  • Formula:

    C8H4INO2

  • Chemical Name:

    5-Iodoisatin

  • Synonyms:

    1H-Indole-2,3-dione,5-iodo-;Indole-2,3-dione,5-iodo-;Isatin,5-iodo-;5-Iodo-1H-indole-2,3-dione;5-Iodoisatin;NSC 92515;5-Iodoindoline-2,3-dione

Description

5-Iodoisatin is a member of indoles. It has a role as an anticoronaviral agent.

5-Iodoisatin Basic Attributes

273.03

273.03

131248

244-035-1

92515

DTXSID50174866

2933990090

Characteristics

46.2

1.56400

red solid

2.1±0.1 g/cm3

264-265 °C @ Solvent: Ethanol, Acetic acid

1.704

soluble acetone, acetic acid, ethanol. Insoluble in water.

Safety Information

LIGHT SENSITIVE

NONH for all modes of transport

3

22-36/37/38-43

26-36

Xn,Xi

Irritant

P261-P280-P305 + P351 + P338

H302-H315-H317-H319-H335

|Warning|H302 (97.56%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 41 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

5-iodoisatin

5-Iodoisatin Use and Manufacturing

Methods of Manufacturing

Derived from the reaction of indolequinone and iodine chloride. Mix indolequinone with absolute ethanol and glacial acetic acid, and heat to reflux until fully dissolved. When the temperature was raised to 90°C, iodine monochloride was added dropwise under stirring. After the addition, the temperature was maintained at 85-90°C, and the reaction was continued for 70 minutes. Cool and filter to obtain red granular crystals. Wash with alcohol to neutrality and dry (a small amount of crystals can be obtained after the mother liquor recovers the solvent). Get the finished product. The yield is over 80%.

Uses

Used in the synthesis of organic iodide.

Computed Properties

Molecular Weight:273.03
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:272.92868
Monoisotopic Mass:272.92868
Topological Polar Surface Area:46.2
Heavy Atom Count:12
Complexity:241
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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