chempirical

1,2-Bis(4-pyridyl)ethane

C12H12N2CAS 4916-57-8184.24 g/mol

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Properties

Molecular formula
C12H12N2
Molar mass
184.24 g/mol
Exact mass
184.1000 Da
Melting point
110–111 °C
Boiling point
95 °C (at 0.6 Torr)
logP
2.26Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
3

Identifiers

CAS number
4916-57-8
SMILES
c1cc(CCc2ccncc2)ccn1
InChIKey
DQRKTVIJNCVZAX-UHFFFAOYSA-N
InChI
InChI=1S/C12H12N2/c1(11-3-7-13-8-4-11)2-12-5-9-14-10-6-12/h3-10H,1-2H2

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Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names
  • Pyridine, 4,4′-(1,2-ethanediyl)bis-
  • Pyridine, 4,4′-ethylenedi-
  • 4,4′-(1,2-Ethanediyl)bis[pyridine]
  • 1,2-Di-4-pyridylethane
  • 1,2-Di(4-pyridinyl)ethane
  • 1,2-Bis(4-pyridinyl)ethane
  • NSC 11477
  • 1,2-Bi(4-pyridyl)ethane

Work with 1,2-Bis(4-pyridyl)ethane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,3-Bis(4′-pyridyl)propane17252-51-675 % similar 4-Propylpyridine1122-81-263 % similar 4-Pyridineethanamine13258-63-463 % similar 4-(3-Phenylpropyl)pyridine2057-49-063 % similar 4-Pyridineethanol5344-27-463 % similar 4-Pyridinemethanamine3731-53-158 % similar 4-Pyridinemethanol586-95-858 % similar 4-Pyridinepropanol2629-72-357 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Aminodiphenylamine101-54-2 4,4′-Dimethyl-2,2′-bipyridine1134-35-6 Hydrazobenzene122-66-7 5,5′-Dimethyl-2,2′-bipyridine1762-34-1 4-tert-Butylphthalonitrile32703-80-3 N-Phenyl-2-pyridinemethanamine4329-81-1 6,6′-Dimethyl-2,2′-bipyridine4411-80-7 N,N-Diphenylhydrazine530-50-7

Elsewhere

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