4-Chloro-3-fluoropicolinaldehyde

CAT: 0127-PC111234-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC111234-01Size:100 mg

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CAS Number

1260878-78-1

Purity

98%

Smiles

O=CC1=NC=CC(Cl)=C1F

Chemical Information

4-Chloro-3-fluoropyridine-2-carbaldehyde

CAS Number	1260878-78-1
PubChem CID	72212767
IUPAC Name	4-chloro-3-fluoropyridine-2-carbaldehyde
Molecular Formula	C6H3ClFNO
Molecular Weight	159.54
XLogP	1.4
Topological Polar Surface Area	30
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	133

SMILES

C1=CN=C(C(=C1Cl)F)C=O

InChI

InChI=1S/C6H3ClFNO/c7-4-1-2-9-5(3-10)6(4)8/h1-3H

InChIKey

NFGGDPYDUVFSCH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1260878-78-1

CID: 72212767

Formula: C6H3ClFNO

MW: 159.54

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	159.54
XLogP3	1.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	158.9887196
Monoisotopic Mass	158.9887196
Topological Polar Surface Area	30 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	133
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
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PC51357-01	3-Chloro-5-fluoropicolinaldehyde
PC102409-01	4-Fluoropicolinaldehyde
PC1001834-01	5-Chloro-6-fluoropicolinaldehyde
PC100575-01	4-Bromo-3-fluoropicolinaldehyde
PC1009312-01	6-chloro-5-fluoropicolinaldehyde
PC1022560-01	3-Fluoropicolinaldehyde hydrochloride
PC1010186-01	5-bromo-4-fluoropicolinaldehyde
PC102200-01	3-Bromo-5-fluoropicolinaldehyde

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