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5-fluoro-6-methylpyridine-2-carbaldehyde

CAT: 1731-GT HW 3486-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:1731-GT HW 3486-01Size:1 mg
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CAS Number
884495-34-5
MDL Number
MFCD08277273
Purity
0.95
Smiles
Cc1nc (C=O) ccc1F
Shipping Conditions
Room temperature, no cold chain required

Chemical Information

5-Fluoro-6-methylpicolinaldehyde
CAS Number884495-34-5
PubChem CID44754863
IUPAC Name5-fluoro-6-methylpyridine-2-carbaldehyde
Molecular FormulaC7H6FNO
Molecular Weight139.13
XLogP1.1
Topological Polar Surface Area30
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity129
SMILES
CC1=C(C=CC(=N1)C=O)F
InChI
InChI=1S/C7H6FNO/c1-5-7(8)3-2-6(4-10)9-5/h2-4H,1H3
InChIKey
NIBFVJVWQLYAGT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Fluoro-6-methylpicolinaldehyde
CAS: 884495-34-5
CID: 44754863
Formula: C7H6FNO
MW: 139.13
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight139.13
XLogP31.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass139.043341977
Monoisotopic Mass139.043341977
Topological Polar Surface Area30 Ų
Heavy Atom Count10
Formal Charge0
Complexity129
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes