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5,5',5''-(Benzene-1,3,5-triyl)tris(pyridin-2-amine)

5,5',5''-(Benzene-1,3,5-triyl)tris(pyridin-2-amine)

Inquiry

Molecular Formula:

C21H18N6

Molecular Weight:

354.41

CAS Number:

2757085-59-7

Catalog Number:

2757085-59-7

Product Information

Molecular Formula:

C21H18N6

Molecular Weight:

354.41

IUPAC Name

5-[3,5-bis(6-aminopyridin-3-yl)phenyl]pyridin-2-amine

Canonical SMILES

C1=CC(=NC=C1C2=CC(=CC(=C2)C3=CN=C(C=C3)N)C4=CN=C(C=C4)N)N

InChI

InChI=1S/C21H18N6/c22-19-4-1-13(10-25-19)16-7-17(14-2-5-20(23)26-11-14)9-18(8-16)15-3-6-21(24)27-12-15/h1-12H,(H2,22,25)(H2,23,26)(H2,24,27)

InChI Key

DQVGGCRGSFCEGR-UHFFFAOYSA-N

Purity

97%

Solubility

Poorly soluble

Safety Information

Hazards

H302-H315-H319-H335

Precautionary Statement

P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

GHS Pictogram

GHS07

Signal Word

Warning

Computed Properties

XLogP3

2.5

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

354.1592946

Monoisotopic Mass

354.1592946

Topological Polar Surface Area

117

Heavy Atom Count

Formal Charge

Complexity

395

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)

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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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5,5',5''-(Benzene-1,3,5-triyl)tris(pyridin-2-amine)

Product Information

Safety Information

Computed Properties

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