AG0076S0

39891-04-8 | 5-Fluoronicotinaldehyde

AG0076S0

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CAS Number	39891-04-8
Catalog Number	AG0076S0(AGN-PC-000L9Q)
Chemical Name	5-Fluoronicotinaldehyde
IUPAC Name	5-fluoropyridine-3-carbaldehyde
InChI	InChI=1S/C6H4FNO/c7-6-1-5(4-9)2-8-3-6/h1-4H
InChI Key	FEPXZFGQVDIXMZ-UHFFFAOYSA-N
MDL Number	MFCD07778429
Molecular Formula	C6H4FNO
Molecular Weight	125.1005
SMILES	FC1=CC(=CN=C1)C=O
Synonyms	5-Fluoronicotinaldehyde, 39891-04-8, 3-Fluoro-5-formylpyridine, 5-Fluoropyridine-3-carbaldehyde, 3-Pyridinecarboxaldehyde, 5-fluoro-, 5-FLUORO-3-PYRIDINECARBOXALDEHYDE, 3-Fluoropyridine-5-carboxaldehyde, MFCD07778429, PubChem5151, 5-Fluoro-3-formylpyridine, ACMC-209j8q, 3-fluoro-5-formyl pyridine, KSC222A3P, SCHEMBL429795, 5-fluoro-3-pyridinecarbaldehyde, CTK1C2037, 5-fluoro-pyridine-3-carbaldehyde, DTXSID40556450, 5-Fluoropyridine-3-carboxaldehyde, FEPXZFGQVDIXMZ-UHFFFAOYSA-N, KS-000008CD, ZINC8698169, ANW-29208, BBL103640, SBB065432, STL557450, AKOS008901346, 3-fluoro-5-formylpyridine, AldrichCPR, CS-W018621, PB12469, PS-9208, RP00762, VP10297, AJ-57967, AK-30355, BC227139, BR-30355, CJ-13364, SC-47887, SY022265, AB0024703, AB1005280, DB-026081, ST2412023, TX-010368, 4CH-013495, A6659, FT-0649987, W6025, MFCD07778429 (95%), B-3461, F67408, I02-0988, W-202639, 5-Fluoronicotinaldehyde; 2-Methyl-5-(trifluoromethyl)-1,3-benzothiazole, C6H4FNO, 3-Pyridinecarboxaldehyde, 5-fluoro- (9CI),

Complexity	107
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	125.028g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	125.102g/mol
Monoisotopic Mass	125.028g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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