chempirical

2-Ethylimidazole

C5H8N2CAS 1072-62-496.13 g/mol

Open in Covalent MOL file
NHN

Properties

Molecular formula
C5H8N2
Molar mass
96.13 g/mol
Exact mass
96.0687 Da
Melting point
61–64 °C
Boiling point
270–275 °C
logP
0.97Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
1072-62-4
SMILES
CCc1ncc[nH]1
InChIKey
PQAMFDRRWURCFQ-UHFFFAOYSA-N
InChI
InChI=1S/C5H8N2/c1-2-5-6-3-4-7-5/h3-4H,2H2,1H3,(H,6,7)

Weigh it out

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

Names and synonyms

5 names
  • Imidazole, 2-ethyl-
  • 2-Ethyl-1H-imidazole
  • Curezol 2EZ
  • 1H-2-Ethylimidazole
  • 1H-Imidazole, 2-ethyl-

Work with 2-Ethylimidazole

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Propylimidazole50995-95-462 % similar 1H-Imidazole-2-methanol3724-26-354 % similar 1H-Imidazole-2-methanamine53332-80-254 % similar 2-Undecylimidazole16731-68-353 % similar 2-Heptadecylimidazole23328-87-253 % similar 2-Methylimidazole693-98-142 % similar 2,2′-Biimidazole492-98-842 % similar 2,3-Diethylpyrazine15707-24-140 % similar

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

Same formula

1,4-Dimethylpyrazole1072-68-0 1-Pyrrolidinecarbonitrile1530-88-7 1,2-Dimethylimidazole1739-84-0 3,4-Dimethylpyrazole2820-37-3 3,5-Dimethylpyrazole67-51-6 1,5-Dimethylpyrazole694-31-5 1-Ethylimidazole7098-07-9 2,4-Dimethylimidazole930-62-1

Elsewhere

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