AG000LOV

1242157-14-7 | 1H-Inden-1-one, 5-bromo-7-fluoro-2,3-dihydro-

AG000LOV

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CAS Number	1242157-14-7
Catalog Number	AG000LOV(AGN-PC-0CXLIN)
Chemical Name	1H-Inden-1-one, 5-bromo-7-fluoro-2,3-dihydro-
IUPAC Name	5-bromo-7-fluoro-2,3-dihydroinden-1-one
InChI	InChI=1S/C9H6BrFO/c10-6-3-5-1-2-8(12)9(5)7(11)4-6/h3-4H,1-2H2
InChI Key	VMPKZIKGIGAVGK-UHFFFAOYSA-N
MDL Number	MFCD17677343
Molecular Formula	C9H6BrFO
Molecular Weight	229.0457
SMILES	BrC=1C=C2CCC(C2=C(C1)F)=O
Synonyms	1242157-14-7, 5-Bromo-7-fluoro-1-indanone, 5-Bromo-7-fluoro-2,3-dihydro-1H-inden-1-one, 1H-Inden-1-one, 5-bromo-7-fluoro-2,3-dihydro-, AMOT0594, SCHEMBL1727000, 5-Bromo-7-fluoro-indan-1-one, DTXSID80732155, VMPKZIKGIGAVGK-UHFFFAOYSA-N, ACT08761, KS-00000C4A, MFCD17677343, ZINC85210576, AKOS016008702, CB-4173, DS-4608, TRA0032818, AK110329, DA-18999, SC-52901, SY019565, 5-bromo-7-fluoro-2,3-dihydroinden-1-one, AJ-126648, TC-307886, CS-0033646, FT-0755646, K-1793, MFCD17677343 (97+%), ACN-030471, 53595-65-6,

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-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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