6-Iodo-2-methyl-1H-benzimidazole

C₈H₇IN₂CAS 2818-70-4258.06 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₇IN₂
Molar mass: 258.06 g/mol
Exact mass: 257.9654 Da
Melting point: 220 °C
logP: 2.48Crippen estimate
Polar surface area: 28.7 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

2818-70-4

SMILES

Cc1nc2ccc(I)cc2[nH]1

InChIKey

NOGZXZDMMNTLAO-UHFFFAOYSA-N

InChI

InChI=1S/C8H7IN2/c1-5-10-7-3-2-6(9)4-8(7)11-5/h2-4H,1H3,(H,10,11)

Weigh it out

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

Names and synonyms

4 names

1H-Benzimidazole, 6-iodo-2-methyl-
Benzimidazole, 5-iodo-2-methyl-
Benzimidazole, 5(or 6)-iodo-2-methyl-
1H-Benzimidazole, 5-iodo-2-methyl-

Work with 6-Iodo-2-methyl-1H-benzimidazole

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-Chloro-2-methylbenzimidazole2818-69-159 % similar 2,5,6-Trimethylbenzimidazole3363-56-256 % similar 2-Methylbenzimidazole615-15-653 % similar 2-Mercapto-5-methylbenzimidazole27231-36-338 % similar 1-Iodo-3,4-dimethylbenzene31599-61-838 % similar 6-Iodo-1H-indole115666-47-236 % similar 6-Bromomethyl-3,4-dihydro-2-methyl-quinazolin-4-one112888-43-435 % similar 4,5-Diiodo-2-methyl-1H-imidazole73746-44-834 % similar

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

Elsewhere

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