AG002YSB

295779-82-7 | 1H-Inden-1-one, 6-fluoro-2,3-dihydro-5-methoxy-

AG002YSB

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CAS Number	295779-82-7
Catalog Number	AG002YSB(AGN-PC-0AMABE)
Chemical Name	1H-Inden-1-one, 6-fluoro-2,3-dihydro-5-methoxy-
IUPAC Name	6-fluoro-5-methoxy-2,3-dihydroinden-1-one
InChI	InChI=1S/C10H9FO2/c1-13-10-4-6-2-3-9(12)7(6)5-8(10)11/h4-5H,2-3H2,1H3
InChI Key	UEAXBANALITWAP-UHFFFAOYSA-N
MDL Number	MFCD18647833
Molecular Formula	C10H9FO2
Molecular Weight	180.1757
SMILES	O=C1CCC2=C1C=C(F)C(OC)=C2
Synonyms	6-Fluoro-5-methoxy-2,3-dihydro-1H-inden-1-one, 295779-82-7, 1H-Inden-1-one, 6-fluoro-2,3-dihydro-5-methoxy-, 6-Fluoro-5-methyl-1-indanone, AMOT0712, SCHEMBL3972786, 5-Methoxy-6-fluoroindan-1-one, DTXSID90717615, 6-Fluoro-5-methoxy-indan-1-one, UEAXBANALITWAP-UHFFFAOYSA-N, MFCD18647833, ZINC91302175, AKOS006372574, CF-1409, NE48978, AK-64649, DS-15608, AJ-130303, 6-FLUORO-5-METHOXY-2,3-DIHYDROINDEN-1-ONE, ACN-030626,

Complexity	217
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.059g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	180.178g/mol
Monoisotopic Mass	180.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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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