2-Chlorodiphenyl ether

C₁₂H₉ClOCAS 2689-07-8204.65 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₁₂H₉ClO
Molar mass: 204.65 g/mol
Exact mass: 204.0342 Da
logP: 4.13Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
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

2689-07-8

SMILES

C1=CC=C(C=C1)OC2=CC=CC=C2Cl

InChIKey

IPBRZLMGGXHHMS-UHFFFAOYSA-N

InChI

InChI=1S/C12H9ClO/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9H

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2-Chlorodiphenyl ether

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

1,3-Diphenoxybenzene3379-38-254 % similar 2-Chloroanisole766-51-852 % similar Diphenyl ether101-84-850 % similar 2-Fluorodiphenyl ether124330-20-750 % similar 2-Methoxyphenyl phenyl ether1695-04-150 % similar 2-Phenoxyaniline2688-84-850 % similar 5-Chloro-2-phenoxybenzenamine93-67-448 % similar 1,4-Diphenoxybenzene3061-36-748 % similar

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

Same formula

2-Naphthaleneacetyl chloride37859-25-9 Chlorophenoxybenzene55398-86-2 4-Chlorophenyl phenyl ether7005-72-3 2-Chloro-4-phenylphenol92-04-6

Elsewhere

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