4-Chloro-5-fluoroisatin - CAS 84378-94-9

Catalog:	BB037186
Product Name:	4-Chloro-5-fluoroisatin
CAS:	84378-94-9
Synonyms:	4-chloro-5-fluoro-1H-indole-2,3-dione; 4-chloro-5-fluoro-1H-indole-2,3-dione

Technical Data

Patents

Computed Properties

IUPAC Name:	4-chloro-5-fluoro-1H-indole-2,3-dione
Description:	4-Chloro-5-fluoroisatin (CAS# 84378-94-9) is a useful research chemical.
Molecular Weight:	199.57
Molecular Formula:	C8H3ClFNO2
Canonical SMILES:	C1=CC(=C(C2=C1NC(=O)C2=O)Cl)F
InChI:	InChI=1S/C8H3ClFNO2/c9-6-3(10)1-2-4-5(6)7(12)8(13)11-4/h1-2H,(H,11,12,13)
InChI Key:	SWUGYKGLXFMLEN-UHFFFAOYSA-N
LogP:	1.75190

Publication Number	Title	Priority Date
CN-111574426-A	Diamine monomer containing isoindigo structure and black polyimide synthesized from diamine monomer	20200527
US-10618897-B2	Spiroindolinones as DDR1 inhibitors	20160208
US-2019071444-A1	Spiroindolinones as ddr1 inhibitors	20160208
EP-3414247-B1	Spiroindolinones as ddr1 inhibitors	20160208
CN-105646490-A	Indole [1, 2-a] pyrimidine [4, 5-b] quinoline-7, 13-diketone compound, preparation method and medical application of compound	20160127

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Related Functional Groups

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Complexity:	271
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	198.9836342
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	198.9836342
Rotatable Bond Count:	0
Topological Polar Surface Area:	46.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4