chempirical

2,4-Dimethylimidazole

C5H8N2CAS 930-62-196.13 g/mol

Open in Covalent MOL file
NNH

Properties

Molecular formula
C5H8N2
Molar mass
96.13 g/mol
Exact mass
96.0687 Da
Melting point
137–142 °C
Boiling point
above 145 °C (at 14 Torr)
logP
1.03Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
930-62-1
SMILES
Cc1cnc(C)[nH]1
InChIKey
LLPKQRMDOFYSGZ-UHFFFAOYSA-N
InChI
InChI=1S/C5H8N2/c1-4-3-6-5(2)7-4/h3H,1-2H3,(H,6,7)

Weigh it out

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

Names and synonyms

9 names
  • 1H-Imidazole, 2,5-dimethyl-
  • Imidazole, 2,4-dimethyl-
  • 1H-Imidazole, 2,4-dimethyl-
  • Imidazole, 2,4(or 2,5)-dimethyl-
  • 2,5-Dimethyl-1H-imidazole
  • 2,5-Dimethylimidazole
  • 2,4-Dimethyl-1H-imidazole
  • NSC 13192
  • 2-Methyl-4-methylimidazole

Work with 2,4-Dimethylimidazole

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

5-Iodo-2-methyl-1H-imidazole73746-45-954 % similar 1,3-Dihydro-4-methyl-2H-imidazol-2-one1192-34-352 % similar 5-Bromo-2-methyl-1H-imidazole16265-11-552 % similar 2-Ethyl-4-methylimidazole931-36-248 % similar 2-Phenyl-4-methylimidazole827-43-046 % similar 2-Methyl-5-nitroimidazole696-23-142 % similar 2-Methyl-5-nitroimidazole88054-22-242 % similar Toxopyrimidine73-67-639 % similar

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

Same formula

2-Ethylimidazole1072-62-4 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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook