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

Inquiry

Molecular Formula:

C18H12N2O2

Molecular Weight:

288.3

CAS Number:

1399191-70-8

Catalog Number:

1399191-70-8

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

Canonical 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

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

288.08987763

Monoisotopic Mass

288.08987763

Topological Polar Surface Area

59.9

Heavy Atom Count

Formal Charge

Complexity

343

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

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

Mass

Concentration

Volume

Molecular Weight *

Calculate

The dilution calculator equation

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

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

Concentration _(start)

Volume _(start)

Concentration _(final)

Volume _(final)

Calculate

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

Product Information

Safety Information

Computed Properties

Related Products