AG00IGIX

911826-36-3 | 4-fluoro-1-benzofuran-3-one

AG00IGIX

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CAS Number	911826-36-3
Catalog Number	AG00IGIX(AGN-PC-07AUXV)
Chemical Name	4-fluoro-1-benzofuran-3-one
IUPAC Name	4-fluoro-1-benzofuran-3-one
InChI	InChI=1S/C8H5FO2/c9-5-2-1-3-7-8(5)6(10)4-11-7/h1-3H,4H2
InChI Key	XNMLJZYMKUNKTL-UHFFFAOYSA-N
MDL Number	MFCD12026471
Molecular Formula	C8H5FO2
Molecular Weight	152.1225
SMILES	FC1=C2C(=O)COC2=CC=C1
Synonyms	4-Fluorobenzofuran-3(2H)-one, 911826-36-3, 4-Fluorobenzo[b]furan-3(2H)-one, 4-fluoro-1-benzofuran-3-one, AK100224, 4-Fluoro-3(2H)-benzofuranone, 3(2H)-Benzofuranone, 4-fluoro-, SCHEMBL1265859, CTK7H4497, KS-00000QTM, DTXSID70669365, XNMLJZYMKUNKTL-UHFFFAOYSA-N, 4-fluoro-1-benzofuran-3(2h)-one, ZX-AP010160, 5225AC, ANW-70433, CF-464, FCH898160, MFCD12026471, PC6226, SBB086821, ZINC36533740, 4-fluoro-2-hydrobenzo[b]furan-3-one, AKOS006319195, DS-3489, AJ-93257, 2,3-Dihydro-4-fluorobenzo[b]furan-3-one, AX8241196, TC-159178, 4CH-012177, ST24023551, 3 -Benzofuranone,4-fluoro-, C8H5FO2,

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	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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