AG000WZ0

1273651-10-7 | 1H-Indene-5-carboxylic acid, 6-fluoro-2,3-dihydro-3-oxo-, methyl ester

AG000WZ0

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CAS Number	1273651-10-7
Catalog Number	AG000WZ0(AGN-PC-0WCXGP)
Chemical Name	1H-Indene-5-carboxylic acid, 6-fluoro-2,3-dihydro-3-oxo-, methyl ester
IUPAC Name	methyl 6-fluoro-3-oxo-1,2-dihydroindene-5-carboxylate
InChI	InChI=1S/C11H9FO3/c1-15-11(14)8-5-7-6(4-9(8)12)2-3-10(7)13/h4-5H,2-3H2,1H3
InChI Key	MZSGXTIKKUDEKC-UHFFFAOYSA-N
MDL Number	MFCD18647885
Molecular Formula	C11H9FO3
Molecular Weight	208.1858
SMILES	O=C(C1=CC2=C(CCC2=O)C=C1F)OC
Synonyms	Methyl 6-fluoro-3-oxo-2,3-dihydro-1H-indene-5-carboxylate, 1273651-10-7, methyl 6-fluoro-3-oxo-1,2-dihydroindene-5-carboxylate, KS-00000T0Y, MFCD18647885, AKOS025395780, ZINC238387647, DS-8153, AK172739, AX8297037, 1H-Indene-5-carboxylic acid, 6-fluoro-2,3-dihydro-3-oxo-, methyl ester,

Complexity	290
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.054g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	208.188g/mol
Monoisotopic Mass	208.054g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	43.4A^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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