AG008TO5

118897-99-7 | 5-broMo-6-fluoroindoline-2,3-dione

AG008TO5

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CAS Number	118897-99-7
Catalog Number	AG008TO5(AGN-PC-0161SE)
Chemical Name	5-broMo-6-fluoroindoline-2,3-dione
IUPAC Name	5-bromo-6-fluoro-1H-indole-2,3-dione
InChI	InChI=1S/C8H3BrFNO2/c9-4-1-3-6(2-5(4)10)11-8(13)7(3)12/h1-2H,(H,11,12,13)
InChI Key	LNXMNYMNZYJVFX-UHFFFAOYSA-N
MDL Number	MFCD06409070
Molecular Formula	C8H3BrFNO2
Molecular Weight	244.0173
SMILES	O=C1NC2=C(C=C(Br)C(F)=C2)C1=O
Synonyms	118897-99-7, 5-Bromo-6-fluoroindoline-2,3-dione, 5-bromo-6-fluoro-1H-indole-2,3-dione, 5-bromo-6-fluoroIsatin, 5-bromo-6-fluoro-2,3-dihydro-1H-indole-2,3-dione, 1H-Indole-2,3-dione, 5-bromo-6-fluoro-, AC1Q4KYU, SCHEMBL1588346, CTK7H5983, DTXSID30588442, BUTTPARK 80\07-03, LNXMNYMNZYJVFX-UHFFFAOYSA-N, CS-D0112, 3187AA, MFCD06409070, ZINC22171399, 5-bromo-6-fluoro-indoline-2,3-dione, AKOS000141913, AM81136, MCULE-4317036347, NE13272, AJ-81212, AS-42091, BC005099, AB0081742, DB-061428, FT-0760021, EN300-37160, AB01003221-01, J-003904, Z425387780, C8H3BrFNO2,

Complexity	271
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.933g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	244.019g/mol
Monoisotopic Mass	242.933g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	46.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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