AG000XQB

128071-77-2 | 3-Pyridinecarboxaldehyde, 4-bromo-2-fluoro-

AG000XQB

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CAS Number	128071-77-2
Catalog Number	AG000XQB(AGN-PC-0NMPHZ)
Chemical Name	3-Pyridinecarboxaldehyde, 4-bromo-2-fluoro-
IUPAC Name	4-bromo-2-fluoropyridine-3-carbaldehyde
InChI	InChI=1S/C6H3BrFNO/c7-5-1-2-9-6(8)4(5)3-10/h1-3H
InChI Key	FNVAZIBHZKWOFE-UHFFFAOYSA-N
MDL Number	MFCD09870050
Molecular Formula	C6H3BrFNO
Molecular Weight	203.9965
SMILES	O=Cc1c(Br)ccnc1F
Synonyms	128071-77-2, 4-Bromo-2-fluoronicotinaldehyde, 4-Bromo-2-fluoro-3-formylpyridine, 4-BROMO-2-FLUOROPYRIDINE-3-CARBOXALDEHYDE, 4-bromo-2-fluoropyridine-3-carbaldehyde, 3-Pyridinecarboxaldehyde, 4-bromo-2-fluoro-, AK-26754, W-205291, ACMC-1C2KM, SCHEMBL4322219, CTK4B5853, DTXSID10650252, FNVAZIBHZKWOFE-UHFFFAOYSA-N, KS-00000OA3, ANW-19008, MFCD09870050, ZINC15444597, AKOS015834852, FCH1394604, RP04441, SB11582, VP13034, AJ-67551, CJ-15162, DS-10867, AB0039846, AX8206186, DB-082276, TR-038947, 4CH-009931, FT-0685422, ST24028943, Y7360, C6H3BrFNO, B-7060,

Complexity	133
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	202.938g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	203.998g/mol
Monoisotopic Mass	202.938g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number