AG002854

2022-78-8 | 2(1H)​-​Pyrimidinone, 5-​fluoro-

AG002854

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CAS Number	2022-78-8
Catalog Number	AG002854(AGN-PC-0JLCUD)
Chemical Name	2(1H)​-​Pyrimidinone, 5-​fluoro-
IUPAC Name	5-fluoro-1H-pyrimidin-2-one
InChI	InChI=1S/C4H3FN2O/c5-3-1-6-4(8)7-2-3/h1-2H,(H,6,7,8)
InChI Key	HPABFFGQPLJKBP-UHFFFAOYSA-N
MDL Number	MFCD00223678
Molecular Formula	C4H3FN2O
Molecular Weight	114.0778
NSC Number	529069
SMILES	Fc1c[nH]c(=O)nc1
UNII	1VXI7T1BI5
Synonyms	5-fluoropyrimidin-2-one, 5-fluoropyrimidin-2-ol, 2022-78-8, 5-Fluoropyrimidin-2(1H)-one, 5-Fluoro-2-hydroxypyrimidine, 2-Hydroxy-5-fluoropyrimidine, 5-Fluoropyrimidin-2-one, 5-Fluoro-2(1H)-pyrimidinone, 214290-48-9, 5-Fluoro-2-pyrimidinol, 5-fluoro-2-pyrimidone, 2(1H)-Pyrimidinone, 5-fluoro-, UNII-1VXI7T1BI5, 2-Pyrimidinol, 5-fluoro- (9CI), 5-fluoro-pyrimidin-2-ol, 1VXI7T1BI5, AK-29925, SMR000449315, NSC529069, NSC 529069, 5-fluoropyrimid-2-one, 5-Fluro-2-pyrimidone, AC1L2QYG, AC1Q4KUN, 5-fluoropyrimidine-2-one, 2-Pyrimidinol, 5-fluoro-, 5-Fluoro-2(1H)-pyrimidone, MLS000758251, MLS001424161, SCHEMBL309070, 5-fluoro-1H-pyrimidin-2-one, CTK8B8297, DTXSID90174067, CHEBI:125539, HPABFFGQPLJKBP-UHFFFAOYSA-N, HMS2051J14, HMS3393J14, KS-000026BF, 0373AB, 5-Fluoro-2-hydroxypyrimidine, 97%, ANW-59936, MFCD00223678, ZINC16697945, 5-fluoro-1,2-dihydropyrimidin-2-one, AKOS006347205, AKOS016004426, CCG-101035, CS-W008541, GS-6508, NC00285, NSC-529069, AC-26618, AJ-69439, CPD000449315, SAM001247017, ST2406262, TC-148681, 4CH-017315, FT-0649189, 2(1H)-Pyrimidinone, 5-fluoro- (8CI)(9CI), J-013132, Fc1cnc(O)nc1, 2-Pyrimidinol,5-fluoro-, D02ONT, C4H3FN2O, 5-Fluoro-2-hydroxypyridimine, 5-FP, C4-H3-F-N2-O, AR-1G8234, CID101498, ACN-052501, 2(1H)-Pyrimidinone, 5-fluoro- (7CI,8CI,9CI), 2061-86-1, DJP,

Complexity	173
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	114.023g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	114.079g/mol
Monoisotopic Mass	114.023g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H318-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number