M-Dppi

C₁₈H₁₃ICAS 87666-86-2356.21 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₈H₁₃I
Molar mass: 356.21 g/mol
Exact mass: 356.0062 Da
logP: 5.63Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
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

87666-86-2

SMILES

C1=CC=C(C=C1)C2=CC(=CC(=C2)I)C3=CC=CC=C3

InChIKey

LICOFADCKUKHJI-UHFFFAOYSA-N

InChI

InChI=1S/C18H13I/c19-18-12-16(14-7-3-1-4-8-14)11-17(13-18)15-9-5-2-6-10-15/h1-13H

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Names and synonyms

1 names

5'-Iodo-m-terphenyl

Work with M-Dppi

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

3-Iodobiphenyl20442-79-968 % similar 1,3,5-Triphenylbenzene612-71-567 % similar 4-Iodobiphenyl1591-31-762 % similar 1,3,5-Tris(4-iodophenyl)benzene151417-38-857 % similar M-Terphenyl92-06-855 % similar 1-Bromo-3,5-diphenylbenzene103068-20-850 % similar Iodobenzene591-50-450 % similar Biphenyl92-52-450 % similar

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

Elsewhere

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