AG000RIO

1260878-78-1 | 2-Pyridinecarboxaldehyde, 4-chloro-3-fluoro-

AG000RIO

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CAS Number	1260878-78-1
Catalog Number	AG000RIO(AGN-PC-0WD4XJ)
Chemical Name	2-Pyridinecarboxaldehyde, 4-chloro-3-fluoro-
IUPAC Name	4-chloro-3-fluoropyridine-2-carbaldehyde
InChI	InChI=1S/C6H3ClFNO/c7-4-1-2-9-5(3-10)6(4)8/h1-3H
InChI Key	NFGGDPYDUVFSCH-UHFFFAOYSA-N
MDL Number	MFCD16249577
Molecular Formula	C6H3ClFNO
Molecular Weight	159.5455
SMILES	O=CC1=NC=CC(Cl)=C1F
Synonyms	4-CHLORO-3-FLUOROPICOLINALDEHYDE, 1260878-78-1, 2-Pyridinecarboxaldehyde, 4-chloro-3-fluoro-, 4-CHLORO-3-FLUOROPYRIDINE-2-CARBALDEHYDE, SCHEMBL14691566, NFGGDPYDUVFSCH-UHFFFAOYSA-N, ZINC95761854, AB70766, QC-11226, AJ-133806,

Complexity	133
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.98872g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	159.54g/mol
Monoisotopic Mass	158.98872g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30Ų
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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