1-Iodo-2,3,4,5-tetramethylbenzene

C₁₀H₁₃ICAS 54509-71-6260.12 g/mol

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Properties

Molecular formula: C₁₀H₁₃I
Molar mass: 260.12 g/mol
Exact mass: 260.0062 Da
logP: 3.52Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

54509-71-6

SMILES

Cc1cc(I)c(C)c(C)c1C

InChIKey

PSTRAAIJGQNXGR-UHFFFAOYSA-N

InChI

InChI=1S/C10H13I/c1-6-5-10(11)9(4)8(3)7(6)2/h5H,1-4H3

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Names and synonyms

2 names

Benzene, 1-iodo-2,3,4,5-tetramethyl-
2,3,4,5-Tetramethyliodobenzene

Work with 1-Iodo-2,3,4,5-tetramethylbenzene

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

Pentamethylbenzene700-12-963 % similar Prehnitene488-23-343 % similar 1-Iodo-2,3-dimethylbenzene31599-60-742 % similar 4-Iodo-2,5-dimethylphenol114971-53-841 % similar 3-Bromo-1,2,4,5-tetramethylbenzene1646-53-340 % similar 2-Iodo-1,4-dimethylbenzene1122-42-537 % similar 1-Iodo-2,4-dimethylbenzene4214-28-237 % similar 1-Iodo-2,3,4,5,6-pentamethylbenzene3853-91-636 % similar

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

Same formula

3-Iodo-1,2,4,5-tetramethylbenzene2100-25-6 1-tert-Butyl-4-iodobenzene35779-04-5

Elsewhere

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