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3-Methyl-1,5-naphthyridine

CAT: 0926-TAA93771-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-TAA93771-01Size:50 mg
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CAS Number
18937-71-8
MDL Number
MFCD11656400
Smiles
CC1=CC2=C (C=CC=N2) N=C1
Molecular Formula
C9H8N2
Molecular Weight
144.17 g/mol
Controlled
No

Chemical Information

3-Methyl-1,5-naphthyridine
CAS Number18937-71-8
PubChem CID588884
IUPAC Name3-methyl-1,5-naphthyridine
Molecular FormulaC9H8N2
Molecular Weight144.17
XLogP1.6
Topological Polar Surface Area25.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity136
SMILES
CC1=CC2=C(C=CC=N2)N=C1
InChI
InChI=1S/C9H8N2/c1-7-5-9-8(11-6-7)3-2-4-10-9/h2-6H,1H3
InChIKey
ABGOJEHSELXHTI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Methyl-1,5-naphthyridine
CAS: 18937-71-8
CID: 588884
Formula: C9H8N2
MW: 144.17
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight144.17
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass144.068748264
Monoisotopic Mass144.068748264
Topological Polar Surface Area25.8 Ų
Heavy Atom Count11
Formal Charge0
Complexity136
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