AG006XRK

23932-84-5 | 6-Fluoroisobenzofuran-1(3H)-one

AG006XRK

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CAS Number	23932-84-5
Catalog Number	AG006XRK(AGN-PC-0NH28Z)
Chemical Name	6-Fluoroisobenzofuran-1(3H)-one
IUPAC Name	6-fluoro-3H-2-benzofuran-1-one
InChI	InChI=1S/C8H5FO2/c9-6-2-1-5-4-11-8(10)7(5)3-6/h1-3H,4H2
InChI Key	LRPVIFOWOOZXEW-UHFFFAOYSA-N
MDL Number	MFCD11053086
Molecular Formula	C8H5FO2
Molecular Weight	152.1225
SMILES	FC1=CC=C2COC(=O)C2=C1
Synonyms	23932-84-5, 6-fluoro-3H-isobenzofuran-1-one, 6-Fluoroisobenzofuran-1(3H)-one, 6-fluoro-2-benzofuran-1(3H)-one, 1(3H)-Isobenzofuranone, 6-fluoro-, 6-fluoro-1(3H)-isobenzofuranone, 6-fluoro-3H-2-benzofuran-1-one, 6-fluoro-1,3-dihydro-2-benzofuran-1-one, 6-Fluorophthalide, PubChem22583, SCHEMBL856120, AMOT0697, CTK0I7680, DTXSID00457515, LRPVIFOWOOZXEW-UHFFFAOYSA-N, 1691AB, 6-fluoranyl-3H-2-benzofuran-1-one, ANW-68021, MFCD11053086, ZINC38324822, AKOS005215808, CF-1416, MCULE-3327536162, AJ-95040, AK-80844, DS-16050, TC-066228, AM20080857, CS-0035468, FT-0652747, L-2985, A816995, I14-5208, F2196-0065, C8H5FO2, ACN-041120, CID11171082,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.027g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	152.124g/mol
Monoisotopic Mass	152.027g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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

Lot Number