4-Bromo-3-fluoropicolinaldehyde

CAT: 0127-PC100575-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC100575-01Size:100 mg

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CAS Number

1289148-65-7

MDL Number

MFCD28738794

Purity

97%

Smiles

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

Chemical Information

4-Bromo-3-fluoropyridine-2-carbaldehyde

CAS Number	1289148-65-7
PubChem CID	87728911
IUPAC Name	4-bromo-3-fluoropyridine-2-carbaldehyde
Molecular Formula	C6H3BrFNO
Molecular Weight	204.00
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(=C1Br)F)C=O

InChI

InChI=1S/C6H3BrFNO/c7-4-1-2-9-5(3-10)6(4)8/h1-3H

InChIKey

QDSZNUHQAFSZCE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1289148-65-7

CID: 87728911

Formula: C6H3BrFNO

MW: 204.00

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	204.00
XLogP3	1.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	202.93820
Monoisotopic Mass	202.93820
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

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