4-Bromo-5-fluoro-7-methylindoline-2,3-dione - CAS 1092350-06-5

Catalog:	BB002405
Product Name:	4-Bromo-5-fluoro-7-methylindoline-2,3-dione
CAS:	1092350-06-5
Synonyms:	4-bromo-5-fluoro-7-methyl-1H-indole-2,3-dione; 4-bromo-5-fluoro-7-methyl-1H-indole-2,3-dione

Technical Data

Patents

Computed Properties

IUPAC Name:	4-bromo-5-fluoro-7-methyl-1H-indole-2,3-dione
Description:	4-Bromo-5-fluoro-7-methylindoline-2,3-dione (CAS# 1092350-06-5 ) is a useful research chemical.
Molecular Weight:	258.04
Molecular Formula:	C9H5BrFNO2
Canonical SMILES:	CC1=CC(=C(C2=C1NC(=O)C2=O)Br)F
InChI:	InChI=1S/C9H5BrFNO2/c1-3-2-4(11)6(10)5-7(3)12-9(14)8(5)13/h2H,1H3,(H,12,13,14)
InChI Key:	GICXJQGLDMHWKA-UHFFFAOYSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	2.16940

Publication Number	Title	Priority Date
US-2009111987-A1	Imino-Indeno[1,2-c] quinoline derivatives, their preparation processes, and pharmaceutical compositions comprising the same	20071031
US-7829567-B2	Imino-indeno[1,2-c] quinoline derivatives, their preparation processes, and pharmaceutical compositions comprising the same	20071031

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Complexity:	297
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	256.94877
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	256.94877
Rotatable Bond Count:	0
Topological Polar Surface Area:	46.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9