CAS 146406-75-9 1,4-Di([2,2':6',2''-terpyridin]-4'-yl)benzene

NAVIGATION

1,4-Di([2,2':6',2''-terpyridin]-4'-yl)benzene

PRICE INQUIRY

Catalog Number

ACM146406759-2

CAS Number

146406-75-9

Product Name

1,4-Di([2,2':6',2''-terpyridin]-4'-yl)benzene

Structure

Category

Customizable MOF Linkers

Synonyms

4',4''''-(1,4-Phenylene)bis(2,2':6',2''-terpyridine); 4-[4-(2,6-Dipyridin-2-ylpyridin-4-yl)phenyl]-2,6-dipyridin-2-ylpyridine

IUPAC Name

4-[4-(2,6-dipyridin-2-ylpyridin-4-yl)phenyl]-2,6-dipyridin-2-ylpyridine

Molecular Weight

540.62

Molecular Formula

C36H24N6

Canonical SMILES

C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C4=CC=C(C=C4)C5=CC(=NC(=C5)C6=CC=CC=N6)C7=CC=CC=N7

InChI

NXMHYAQTBVTLRK-UHFFFAOYSA-N

InChI Key

InChI=1S/C36H24N6/c1-5-17-37-29(9-1)33-21-27(22-34(41-33)30-10-2-6-18-38-30)25-13-15-26(16-14-25)28-23-35(31-11-3-7-19-39-31)42-36(24-28)32-12-4-8-20-40-32/h1-24H

Boiling Point

340 °C (dec.)-lit.

Melting Point

340 °C (dec.)-lit.

Purity

98%

Appearance

Grey white solid

Complexity

697

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

540.20624479

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

540.20624479

Rotatable Bond Count

Topological Polar Surface Area

77.3 Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

5.5

MSDS

Download MSDS

COA

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Spec Sheet

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