1,4-Diiodo-2,5-dimethoxybenzene

C₈H₈I₂O₂CAS 51560-21-5389.96 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₈H₈I₂O₂
Molar mass: 389.96 g/mol
Exact mass: 389.8614 Da
logP: 2.91Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

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

51560-21-5

SMILES

COC1=CC(=C(C=C1I)OC)I

InChIKey

GLVOXVCTGAISRY-UHFFFAOYSA-N

InChI

InChI=1S/C8H8I2O2/c1-11-7-3-6(10)8(12-2)4-5(7)9/h3-4H,1-2H3

Weigh it out

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Work with 1,4-Diiodo-2,5-dimethoxybenzene

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

1-Iodo-2,4-dimethoxybenzene20469-63-060 % similar 2C-I69587-11-759 % similar 4-Chloro-2-iodoanisole52807-27-956 % similar 3-Iodo-4-methoxybenzenamine74587-12-556 % similar 4-Bromo-1-iodo-2-methoxybenzene791642-68-756 % similar 2-Iodoanisole529-28-254 % similar 3-Iodo-4-methoxybenzaldehyde2314-37-650 % similar 2,3,6,7,10,11-Hexamethoxytriphenylene808-57-148 % similar

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

Elsewhere

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