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5-Methoxy-6-methylpicolinaldehyde

CAT: 0127-OR1081727Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1081727Size:250 mg
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CAS Number
1256835-67-2
MDL Number
MFCD14706554
Purity
95%
Smiles
C1c (nc (c (c1) OC) C) C=O

Chemical Information

5-Methoxy-6-methyl-2-pyridinecarboxaldehyde
CAS Number1256835-67-2
PubChem CID92019925
IUPAC Name5-methoxy-6-methylpyridine-2-carbaldehyde
Molecular FormulaC8H9NO2
Molecular Weight151.16
XLogP1
Topological Polar Surface Area39.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity138
SMILES
CC1=C(C=CC(=N1)C=O)OC
InChI
InChI=1S/C8H9NO2/c1-6-8(11-2)4-3-7(5-10)9-6/h3-5H,1-2H3
InChIKey
XASPBWGZUJERJH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Methoxy-6-methyl-2-pyridinecarboxaldehyde
CAS: 1256835-67-2
CID: 92019925
Formula: C8H9NO2
MW: 151.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight151.16
XLogP31
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass151.063328530
Monoisotopic Mass151.063328530
Topological Polar Surface Area39.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity138
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