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5-Ethenyl-2-methoxy-pyridine

CAT: 0926-ZAA67439-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0926-ZAA67439-01Size:250 mg
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CAS Number
24674-39-3
MDL Number
MFCD13175951
Smiles
COC1=NC=C (C=C1) C=C
Molecular Formula
C8H9NO
Molecular Weight
135.17 g/mol
Controlled
No

Chemical Information

5-Ethenyl-2-methoxypyridine
CAS Number24674-39-3
PubChem CID23070135
IUPAC Name5-ethenyl-2-methoxypyridine
Molecular FormulaC8H9NO
Molecular Weight135.16
XLogP1.9
Topological Polar Surface Area22.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity114
SMILES
COC1=NC=C(C=C1)C=C
InChI
InChI=1S/C8H9NO/c1-3-7-4-5-8(10-2)9-6-7/h3-6H,1H2,2H3
InChIKey
DWPLODZUCBLLIE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Ethenyl-2-methoxypyridine
CAS: 24674-39-3
CID: 23070135
Formula: C8H9NO
MW: 135.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight135.16
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass135.068413911
Monoisotopic Mass135.068413911
Topological Polar Surface Area22.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity114
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