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4-Methylpyridazine

CAT: 0024-sc-226749Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-226749Size:500 mg
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CAS Number
1120-88-3

Chemical Information

4-Methylpyridazine
CAS Number1120-88-3
PubChem CID136882
IUPAC Name4-methylpyridazine
Molecular FormulaC5H6N2
Molecular Weight94.11
XLogP-0.3
Topological Polar Surface Area25.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count7
Formal Charge0
Complexity54
SMILES
CC1=CN=NC=C1
InChI
InChI=1S/C5H6N2/c1-5-2-3-6-7-4-5/h2-4H,1H3
InChIKey
AIKUBOPKWKZULG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Methylpyridazine
CAS: 1120-88-3
CID: 136882
Formula: C5H6N2
MW: 94.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight94.11
XLogP3-0.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass94.053098200
Monoisotopic Mass94.053098200
Topological Polar Surface Area25.8 Ų
Heavy Atom Count7
Formal Charge0
Complexity54
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

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