(5-Iodo-2-chlorophenyl)(4-ethoxyphenyl)methanone

C₁₅H₁₂ClIO₂CAS 1103738-26-6386.61 g/mol

Open in Covalent MOL file

Aryl halide Ether Ketone

Properties

Molecular formula: C₁₅H₁₂ClIO₂
Molar mass: 386.61 g/mol
Exact mass: 385.9571 Da
logP: 4.57Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

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

1103738-26-6

SMILES

CCOC1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)I)Cl

InChIKey

BGRJXWMKCUZBIG-UHFFFAOYSA-N

InChI

InChI=1S/C15H12ClIO2/c1-2-19-12-6-3-10(4-7-12)15(18)13-9-11(17)5-8-14(13)16/h3-9H,2H2,1H3

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Names and synonyms

1 names

(2-Chloro-5-iodophenyl)(4-ethoxyphenyl)methanone

Work with (5-Iodo-2-chlorophenyl)(4-ethoxyphenyl)methanone

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-Bromo-2-chlorophenyl)(4-ethoxyphenyl)methanone461432-22-470 % similar (2-Chloro-5-iodophenyl)(4-(((3S)-tetrahydro-3-furanyl)oxy)phenyl)methanone915095-87-362 % similar (2-Chlor-5-iod-phenyl)-(4-fluoro-phenyl)-methanone915095-86-261 % similar 4-Iodo-1-chloro-2-(4-ethoxybenzyl)benzene1103738-29-955 % similar 1-Ethoxy-4-iodobenzene699-08-149 % similar 4-Ethoxybenzoyl chloride16331-46-746 % similar 2-Chloro-5-iodobenzoic acid19094-56-545 % similar 1-(4-Ethoxyphenyl)ethanone1676-63-743 % similar

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

Elsewhere

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