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2,3':4',3''-Terpyridine

CAT: 0127-OR1055070-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1055070-01Size:25 mg
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CAS Number
2973762-99-9
Purity
97%
Smiles
C1(C2=NC=CC=C2)=C(C3=CC=CN=C3)C=CN=C1

Chemical Information

2,3':4',3''-Terpyridine
CAS Number2973762-99-9
PubChem CID127256282
IUPAC Name3-pyridin-2-yl-4-pyridin-3-ylpyridine
Molecular FormulaC15H11N3
Molecular Weight233.27
XLogP2
Topological Polar Surface Area38.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity256
SMILES
C1=CC=NC(=C1)C2=C(C=CN=C2)C3=CN=CC=C3
InChI
InChI=1S/C15H11N3/c1-2-8-18-15(5-1)14-11-17-9-6-13(14)12-4-3-7-16-10-12/h1-11H
InChIKey
XTLUVIORNRMPNA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,3':4',3''-Terpyridine
CAS: 2973762-99-9
CID: 127256282
Formula: C15H11N3
MW: 233.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight233.27
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass233.095297364
Monoisotopic Mass233.095297364
Topological Polar Surface Area38.7 Ų
Heavy Atom Count18
Formal Charge0
Complexity256
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