ChemicalBook--->CAS DataBase List--->17630-76-1

17630-76-1

17630-76-1 Structure

17630-76-1 Structure
IdentificationMore
[Name]

5-Chloroisatin
[CAS]

17630-76-1
[Synonyms]

5-CHLOR-2,3-DIOXOINDOLIN
5-CHLOR-2,3-INDOLINDION
5-CHLORO-1H-INDOLE-2,3-DIONE
5-CHLORO-2,3-INDOLINEDIONE
5-CHLOROINDOLE-2,3-DIONE
5-CHLOROISATIN
AKOS BBS-00000996
AURORA KA-5424
BUTTPARK 50\07-91
TIMTEC-BB SBB003741
1H-Indole-2,3-dione,5-chloro-
5-choroisatin
5-Chlorisatin
5-CHLORISATIDE
5-CHLOROISATIN/5-CHLORO-2,3-INDOLINEDIONE
5-Chloroindolin-2,3-dione
5-Chloroisatin ,98%
[EINECS(EC#)]

241-614-0
[Molecular Formula]

C8H4ClNO2
[MDL Number]

MFCD00014567
[Molecular Weight]

181.58
[MOL File]

17630-76-1.mol
Chemical PropertiesBack Directory
[Appearance]

pale yellow to reddish or yellow-brownish powder
[Melting point ]

254-258 °C (lit.)
[density ]

1.3743 (rough estimate)
[refractive index ]

1.5560 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

Powder
[pka]

8.65±0.20(Predicted)
[Water Solubility ]

insoluble
[Detection Methods]

HPLC,NMR
[BRN ]

383759
[InChI]

InChI=1S/C8H4ClNO2/c9-4-1-2-6-5(3-4)7(11)8(12)10-6/h1-3H,(H,10,11,12)
[InChIKey]

XHDJYQWGFIBCEP-UHFFFAOYSA-N
[SMILES]

N1C2=C(C=C(Cl)C=C2)C(=O)C1=O
[CAS DataBase Reference]

17630-76-1(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[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:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HS Code ]

29339900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

5-Chloroindole-->Chloral hydrate-->carbon monoxide-->Isatin-->4-Chloroaniline
[Preparation Products]

5-Chloro indazole-3-carboxaldehyde-->(5-Chloro-1H-indazol-3-yl)-methanol ,97%-->5-Chlorooxindole-->5-Chloro-1H-indazole-3-carboxylic acid-->2-Amino-5-chlorobenzoic acid-->6-Chloro-2-(4-methoxyphenyl)quinoline-4-carboxylic acid-->Benzenamine,2-(1H-benzimidazol-2-yl)-4-chloro--->5-Chloro-1-(2,6-dichlorobenzyl)-1H-indole-2,3-dione-->6-Chloro-2-(4-ethylphenyl)quinoline-4-carboxylicacid-->5-Chloro-1-methylindolin-2-one
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

5-Chloro-1H-indole-2,3-dione(17630-76-1).msds
Hazard InformationBack Directory
[Chemical Properties]

pale yellow to reddish or yellow-brownish powder
[Uses]

5-Chloroisatin is a reagent used in the synthesis of Schiff bases through the reaction with 2-methyl-4-nitroaniline or 4-amino-4,5-dihydro-1H-1,2,3-triazole-5-one.
[Definition]

ChEBI: 5-Chloro-1H-indole-2,3-dione is a member of indoles. It has a role as an anticoronaviral agent.
[General Description]

5-Chloroisatin reacts with substituted 4-amino-4,5-dihydro-1H-1,2,4-triazole-5-ones to yield Schiff bases.
Spectrum DetailBack Directory
[Spectrum Detail]

5-Chloroisatin(17630-76-1)1HNMR
5-Chloroisatin(17630-76-1)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

5-Chloroisatin, 95%(17630-76-1)
[Alfa Aesar]

5-Chloroisatin, 98%(17630-76-1)
[Sigma Aldrich]

17630-76-1(sigmaaldrich)
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