chempirical

2,2′-Biimidazole

C6H6N4CAS 492-98-8134.14 g/mol

Open in Covalent MOL file
NHNHNN

Properties

Molecular formula
C6H6N4
Molar mass
134.14 g/mol
Exact mass
134.0592 Da
Melting point
above 300 °C
logP
0.80Crippen estimate
Polar surface area
57.4 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Identifiers

CAS number
492-98-8
SMILES
c1c[nH]c(-c2ncc[nH]2)n1
InChIKey
AZUHIVLOSAPWDM-UHFFFAOYSA-N
InChI
InChI=1S/C6H6N4/c1-2-8-5(7-1)6-9-3-4-10-6/h1-4H,(H,7,8)(H,9,10)

Weigh it out

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

Names and synonyms

10 names
  • 2,2′-Bi-1H-imidazole
  • Glycosine of debus
  • 2,2′-Diimidazole
  • 2,2′-Biimidazolyl
  • 2,2′-Bisimidazole
  • NSC 522950
  • 1H,1′H-2,2′-Biimidazole
  • H2BIm
  • 1H,1′H-[2,2′]Biimidazolyl
  • 2-(1H-Imidazol-2-yl)-1H-imidazole

Work with 2,2′-Biimidazole

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

2-Phenylimidazole670-96-262 % similar 2-Chloro-1H-imidazole16265-04-648 % similar 1,3-Dihydro-2H-imidazol-2-one5918-93-448 % similar 2-Methylimidazole693-98-148 % similar 2-Imidazolidinethione872-35-548 % similar Imidazole-2-carboxaldehyde10111-08-743 % similar 4-(1H-Imidazol-2-yl)benzoic Acid108035-45-643 % similar 4-Fluoro-1H-pyrrolo[2,3-B]pyridine640735-23-542 % similar

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

Same formula

7-Deazaadenine1500-85-2 1-Aminobenzotriazole1614-12-6 4-Amino-2-methyl-5-pyrimidinecarbonitrile698-29-3

Elsewhere

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