4,4'-Dinonyl-2,2'-dipyridyl

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Product Information

Molecular Formula:
C28H44N2
Molecular Weight:
408.66
Description
4,4'-Dimethyl-2,2'-dipyridyl (dmbipy) may be used as a ligand in the synthesis of : carbonato-bridged triangular trinuclear compounds and tetranuclear hydroxo-bridged compounds; dmbipy-copper bridged complexes, which show variation in crystal geometries, thermal and magnetic properties.
Synonyms
4-nonyl-2-(4-nonylpyridin-2-yl)pyridine
IUPAC Name
4-nonyl-2-(4-nonylpyridin-2-yl)pyridine
Canonical SMILES
CCCCCCCCCC1=CC(=NC=C1)C2=NC=CC(=C2)CCCCCCCCC
InChI
InChI=1S/C28H44N2/c1-3-5-7-9-11-13-15-17-25-19-21-29-27(23-25)28-24-26(20-22-30-28)18-16-14-12-10-8-6-4-2/h19-24H,3-18H2,1-2H3
InChI Key
VHJFWJXYEWHCGD-UHFFFAOYSA-N
Boiling Point
522.4 ℃ at 760 mmHg
Melting Point
61-63 ℃ (lit.)
Flash Point
228.2 °F
Purity
> 98.0 % (T)
Density
0.933 g/cm3
Appearance
White crystal or powder
Refractive Index
n20/D 1.519
LogP
8.72980

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning

Computed Properties

XLogP3
10.7
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
17
Exact Mass
408.350449412 g/mol
Monoisotopic Mass
408.350449412 g/mol
Topological Polar Surface Area
25.8Ų
Heavy Atom Count
30
Formal Charge
0
Complexity
347
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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