AG00I7TT

399-88-2 | Pyridine, 3-fluoro-4-methyl-

AG00I7TT

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CAS Number	399-88-2
Catalog Number	AG00I7TT(AGN-PC-0JMGSU)
Chemical Name	Pyridine, 3-fluoro-4-methyl-
IUPAC Name	3-fluoro-4-methylpyridine
InChI	InChI=1S/C6H6FN/c1-5-2-3-8-4-6(5)7/h2-4H,1H3
InChI Key	WZMOEPZZTTWDIA-UHFFFAOYSA-N
MDL Number	MFCD04114226
Molecular Formula	C6H6FN
Molecular Weight	111.1169
SMILES	CC1=C(F)C=NC=C1
Synonyms	3-Fluoro-4-methylpyridine, 399-88-2, 3-fluoro-4-picoline, PYRIDINE, 3-FLUORO-4-METHYL-, 4-methyl-3-fluoropyridine, MFCD04114226, AK-28364, Q-101506, zlchem 994, PubChem9251, ACMC-1AGEA, AC1L82MA, 3-fluoro-4-methyl pyridine, 3-fluoro-4-methyl-pyridine, SCHEMBL91449, KSC925S4F, Jsp006923, CTK8C5942, KS-00000KQW, DTXSID70323076, ZLD0460, WZMOEPZZTTWDIA-UHFFFAOYSA-N, ABBYPHARMA AP-14-5353, BCP22151, ZINC2599054, ZX-AP001516, AC-441, FCH919072, PC9930, AKOS005063622, AB18002, AF10155, AM62392, AN-1993, AS04731, HCH0027823, LS20260, PS-9261, RP00523, VP10810, AJ-43846, BC219203, CC-15096, CJ-10480, I739, SY016334, TL806104, AB0013869, AB1005285, AX8003494, DB-006442, ST2405074, TC-010892, 4CH-018322, F0852, FT-0601484, MFCD04114226 (98%), C-6076, 3-Fluoro-4-methylpyridine (3-Fluoro-4-picoline), 399F882, C-00429, I02-0448, C6H6FN, CID345367, ZINC02599054, 5-Fluoro-1H-indole-2-carboxylic acid, ACN-028287, (1-(5-CARBOXYPENTYL)-3,3-DIMETHYL-3H-INDOL-1-IUM-2-YL)METHANIDE HYDROBROMIDE, 98-97-5,

Complexity	74.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	111.048g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	111.119g/mol
Monoisotopic Mass	111.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

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