chempirical

1-Vinylimidazole

C5H6N2CAS 1072-63-594.12 g/mol

Open in Covalent MOL file
NN
Alkene

Properties

Molecular formula
C5H6N2
Molar mass
94.12 g/mol
Exact mass
94.0531 Da
Density
1.0414 g/mL (at 20 °C)
Boiling point
100–113 °C (at 20 Torr)
logP
0.98Crippen estimate
Polar surface area
17.8 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
1072-63-5
SMILES
C=Cn1ccnc1
InChIKey
OSSNTDFYBPYIEC-UHFFFAOYSA-N
InChI
InChI=1S/C5H6N2/c1-2-7-4-3-6-5-7/h2-5H,1H2

Weigh it out

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

Names and synonyms

6 names
  • 1H-Imidazole, 1-ethenyl-
  • Imidazole, 1-vinyl-
  • 1-Ethenyl-1H-imidazole
  • N-Vinylimidazole
  • 1-Vinyl-1H-imidazole
  • 1-Ethenylimidazole

Work with 1-Vinylimidazole

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-Allylimidazole31410-01-241 % similar 1-Methylimidazole616-47-735 % similar 1,2,4,5-Tetra(1H-imidazol-1-yl)benzene1220714-37-332 % similar (Trimethylsilyl)imidazole18156-74-631 % similar 1-(1-Methylethyl)-1H-imidazole4532-96-131 % similar Carbonyldiimidazole530-62-131 % similar Thiocarbonyldiimidazole6160-65-231 % similar 1-Ethylimidazole7098-07-931 % similar

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

Same formula

Methylpyrazine109-08-0 4-Methylpyridazine1120-88-3 3-Methylpyridazine1632-76-4 5-Methylpyrimidine2036-41-1 4-Methylpyrimidine3438-46-8 3-Aminopyridine462-08-8 4-Aminopyridine504-24-5 2-Aminopyridine504-29-0

Elsewhere

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