AG004EM4

884495-30-1 | 5-Fluoro-2-methoxyisonicotinic acid

AG004EM4

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CAS Number	884495-30-1
Catalog Number	AG004EM4(AGN-PC-078JOD)
Chemical Name	5-Fluoro-2-methoxyisonicotinic acid
IUPAC Name	5-fluoro-2-methoxypyridine-4-carboxylic acid
InChI	InChI=1S/C7H6FNO3/c1-12-6-2-4(7(10)11)5(8)3-9-6/h2-3H,1H3,(H,10,11)
InChI Key	CKSDXJOTYUMLJF-UHFFFAOYSA-N
MDL Number	MFCD08277267
Molecular Formula	C7H6FNO3
Molecular Weight	171.1258
SMILES	O=C(O)C1=C(F)C=NC(OC)=C1
Synonyms	5-FLUORO-2-METHOXYISONICOTINIC ACID, 884495-30-1, 5-fluoro-2-methoxy-4-Pyridinecarboxylic acid, 5-FLUORO-2-METHOXYPYRIDINE-4-CARBOXYLIC ACID, 5-Fluoro-2-MethoxyisonicotinicAcid, PubChem17143, SCHEMBL3938101, CTK3E6276, KS-00001BBW, DTXSID60660548, CKSDXJOTYUMLJF-UHFFFAOYSA-N, CS-D0436, 4136AC, ANW-60445, MFCD08277267, ZINC15684447, AKOS006285012, DS-3669, QC-1165, AJ-67785, AK101055, SC-23001, DB-027596, TC-040090, FT-0731169, 5-fluoro-2-methoxy-pyridine-4-carboxylic acid, 5-fluoro-2-methoxyisonicotinic acid, AldrichCPR, I02-2336, C7H6FNO3, 5-fluoro-2-methoxyisonicotinaldehyde, A10543,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.033g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	171.127g/mol
Monoisotopic Mass	171.033g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	59.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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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