chempirical

2-Iodo-1H-imidazole

C3H3IN2CAS 3034-62-6193.98 g/mol

Open in Covalent MOL file
NNHI
Aryl halide

Properties

Molecular formula
C3H3IN2
Molar mass
193.98 g/mol
Exact mass
193.9341 Da
logP
1.01Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
3034-62-6
SMILES
C1=CN=C(N1)I
InChIKey
MHHDMDLNVVCTAJ-UHFFFAOYSA-N
InChI
InChI=1S/C3H3IN2/c4-3-5-1-2-6-3/h1-2H,(H,5,6)

Weigh it out

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

Names and synonyms

1 names
  • 2-Iodoimidazole

Work with 2-Iodo-1H-imidazole

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

2,2′-Biimidazole492-98-848 % similar 2-Chloro-1H-imidazole16265-04-642 % similar 2-Bromo-1H-imidazole16681-56-442 % similar 1,3-Dihydro-2H-imidazol-2-one5918-93-442 % similar 2-Methylimidazole693-98-142 % similar 2-Imidazolidinethione872-35-542 % similar Imidazole-2-carboxaldehyde10111-08-738 % similar 2-Ethylimidazole1072-62-437 % similar

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

Same formula

4-Iodopyrazole3469-69-0 3-Iodo-1H-pyrazole4522-35-4 4-Iodo-1H-imidazole71759-89-2

Elsewhere

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