AG000QP0

1260011-83-3 | 1H-Inden-1-one, 7-bromo-6-fluoro-2,3-dihydro-

AG000QP0

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CAS Number	1260011-83-3
Catalog Number	AG000QP0(AGN-PC-0WCTZU)
Chemical Name	1H-Inden-1-one, 7-bromo-6-fluoro-2,3-dihydro-
IUPAC Name	7-bromo-6-fluoro-2,3-dihydroinden-1-one
InChI	InChI=1S/C9H6BrFO/c10-9-6(11)3-1-5-2-4-7(12)8(5)9/h1,3H,2,4H2
InChI Key	PVWJFHDXZQXBRZ-UHFFFAOYSA-N
MDL Number	MFCD18208172
Molecular Formula	C9H6BrFO
Molecular Weight	229.0457
SMILES	O=C1CCC2=C1C(Br)=C(F)C=C2
Synonyms	1260011-83-3, 7-BROMO-6-FLUORO-1-INDANONE, 7-Bromo-6-fluoro-2,3-dihydro-1H-inden-1-one, AK172658, SCHEMBL17605997, PVWJFHDXZQXBRZ-UHFFFAOYSA-N, MFCD18208172, ZINC84192975, AKOS025395720, EBD3321685, FCH1364389, AS-49475, AX8297002, 1H-Inden-1-one, 7-bromo-6-fluoro-2,3-dihydro-,

Complexity	207
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	227.959g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	229.048g/mol
Monoisotopic Mass	227.959g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H320-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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