5,5'-(1,4-Phenylene)dipicolinaldehyde

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Product Information

Molecular Formula
C18H12N2O2
Molecular Weight
288.3
Synonyms
5,5'-(1,4-Phenylene)dipicolinaldehyde; 5-[4-(6-formylpyridin-3-yl)phenyl]pyridine-2-carbaldehyde
IUPAC Name
5-[4-(6-formylpyridin-3-yl)phenyl]pyridine-2-carbaldehyde
SMILES
C1=CC(=CC=C1C2=CN=C(C=C2)C=O)C3=CN=C(C=C3)C=O
InChI
InChI=1S/C18H12N2O2/c21-11-17-7-5-15(9-19-17)13-1-2-14(4-3-13)16-6-8-18(12-22)20-10-16/h1-12H
InChI Key
LOSZXONRCMCJCY-UHFFFAOYSA-N
Purity
98%

Safety Information

Hazards
H302-H315-H319-H335
Precautionary Statement
P261-P280-P301+P312-P302+P352-P305+P351+P338
GHS Pictogram
GHS07
Signal Word
Warning

Computed Properties

XLogP3
2.6
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
4
Exact Mass
288.08987763
Monoisotopic Mass
288.08987763
Topological Polar Surface Area
59.9
Heavy Atom Count
22
Formal Charge
0
Complexity
343
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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