2-Ethylimidazole
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
Hazards
Danger
- H302 Harmful if swallowed45% of notifiers
- H315 Causes skin irritation85.4% of notifiers
- H318 Causes serious eye damage45% of notifiers
- H319 Causes serious eye irritation40.4% of notifiers
- H335 May cause respiratory irritation66.2% of notifiers
Aggregated from 151 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1072-62-4SMILES
CCc1ncc[nH]1InChIKey
PQAMFDRRWURCFQ-UHFFFAOYSA-NInChI
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
2-Butyl-1H-imidazole50790-93-757 % similar
1H-Imidazole-2-methanol3724-26-354 % similar
2-Aminomethyl-1H-imidazole53332-80-254 % similar
2-Undecylimidazole16731-68-353 % similar
2-Heptadecylimidazole23328-87-253 % similar
1H-Imidazol-2-ylmethylamine dihydrochloride22600-77-748 % similar
2-Methylimidazole693-98-142 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.