4-Iodo-1,2-dimethoxybenzene

C₈H₉IO₂CAS 5460-32-2264.06 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₈H₉IO₂
Molar mass: 264.06 g/mol
Exact mass: 263.9647 Da
logP: 2.31Crippen 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

5460-32-2

SMILES

COC1=C(C=C(C=C1)I)OC

InChIKey

PUCISUQLWLKKJH-UHFFFAOYSA-N

InChI

InChI=1S/C8H9IO2/c1-10-7-4-3-6(9)5-8(7)11-2/h3-5H,1-2H3

Weigh it out

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Names and synonyms

8 names

3,4-Dimethoxyiodobenzene
4-Iodo-1,2-dimethoxy-benzene
4-Iodoveratrol
3,4-Dimethoxyphenyl iodide
Benzene, 4-iodo-1,2-dimethoxy-
1,2-Dimethoxy-4-iodobenzene
4-Iodoveratrole
4-Iodov

Work with 4-Iodo-1,2-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

5-Iodo-2-methoxyaniline77770-09-367 % similar 1,2,4-Trimethoxybenzene135-77-354 % similar 3,4-Dimethoxytoluene494-99-552 % similar 3,4-Dimethoxyphenol2033-89-850 % similar Bromoveratrole2859-78-150 % similar 4-Fluoro-1,2-dimethoxybenzene398-62-950 % similar 3,4-Ethylenedioxyiodobenzene57744-67-950 % similar 1-Iodo-3,4-methylenedioxybenzene5876-51-750 % similar

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

Same formula

1-Iodo-2,4-dimethoxybenzene20469-63-0

Elsewhere

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