4-Iodo-1-chloro-2-(4-ethoxybenzyl)benzene

C₁₅H₁₄ClIOCAS 1103738-29-9372.63 g/mol

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Aryl halide Ether

Properties

Molecular formula: C₁₅H₁₄ClIO
Molar mass: 372.63 g/mol
Exact mass: 371.9778 Da
logP: 4.93Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 4

Identifiers

CAS number

1103738-29-9

SMILES

CCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)I)Cl

InChIKey

CZFRIPGHKLGMEU-UHFFFAOYSA-N

InChI

InChI=1S/C15H14ClIO/c1-2-18-14-6-3-11(4-7-14)9-12-10-13(17)5-8-15(12)16/h3-8,10H,2,9H2,1H3

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Names and synonyms

1 names

1-Chloro-2-(4-ethoxybenzyl)-4-iodobenzene

Work with 4-Iodo-1-chloro-2-(4-ethoxybenzyl)benzene

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

4-Bromo-1-chloro-2-[(4-ethoxyphenyl)methyl]benzene461432-23-569 % similar (3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydrofuran915095-94-259 % similar (5-Iodo-2-chlorophenyl)(4-ethoxyphenyl)methanone1103738-26-655 % similar 1-Ethoxy-4-iodobenzene699-08-154 % similar Sotagliflozin1018899-04-150 % similar Dapagliflozin461432-26-850 % similar Ertugliflozin1210344-57-246 % similar Methyl 1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-α-D-glucopyranoside714269-57-545 % similar

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

Elsewhere

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