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1H-Indole-2,3-dione,6-chloro-5-fluoro- (96202-57-2)

Identification
Name:1H-Indole-2,3-dione,6-chloro-5-fluoro-
Synonyms:6-Chloro-5-fluoro-1H-indole-2,3-dione;6-Chloro-5-fluoroisatin;
CAS:96202-57-2
Molecular Formula: C8H3ClFNO2
Molecular Weight: 0
Molecular Structure: (C8H3ClFNO2) 6-Chloro-5-fluoro-1H-indole-2,3-dione;6-Chloro-5-fluoroisatin;
Properties
Density:1.613 g/cm3
Specification:

The cas register number of 5-Fluoro-6-chloroisatin is 96202-57-2. It also can be called as 5-Fluoro-6-chloro-2,3-indolinedione and the Systematic name about this chemical is 6-chloro-5-fluoro-1H-indole-2,3-dione.

Physical properties about 5-Fluoro-6-chloroisatin are: (1)ACD/LogP: 2.19; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 12; (5)ACD/BCF (pH 7.4): 7; (6)ACD/KOC (pH 5.5): 211; (7)ACD/KOC (pH 7.4): 118; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)Polar Surface Area: 46.17Å2; (11)Index of Refraction: 1.6; (12)Molar Refractivity: 42.313 cm3; (13)Molar Volume: 123.713 cm3; (14)Polarizability: 16.774x10-24cm3; (15)Surface Tension: 54.106 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc2c(cc1Cl)NC(=O)C2=O
(2)InChI: InChI=1/C8H3ClFNO2/c9-4-2-6-3(1-5(4)10)7(12)8(13)11-6/h1-2H,(H,11,12,13)
(3)InChIKey: GHBWNCFDSGAFIT-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C8H3ClFNO2/c9-4-2-6-3(1-5(4)10)7(12)8(13)11-6/h1-2H,(H,11,12,13)
(5)Std. InChIKey: GHBWNCFDSGAFIT-UHFFFAOYSA-N

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