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C₁₂H₁₇Cl₂NOCAS 65202-07-5262.17 g/mol

Open in Covalent MOL file

Aryl halide Ether Tertiary amine

Properties

Molecular formula: C₁₂H₁₇Cl₂NO
Molar mass: 262.17 g/mol
Exact mass: 261.0687 Da
logP: 3.71Crippen estimate
Polar surface area: 12.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 6

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

65202-07-5

SMILES

CCN(CC)CCOC1=CC(=C(C=C1)Cl)Cl

InChIKey

LOVYCUYJRWLTSU-UHFFFAOYSA-N

InChI

InChI=1S/C12H17Cl2NO/c1-3-15(4-2)7-8-16-10-5-6-11(13)12(14)9-10/h5-6,9H,3-4,7-8H2,1-2H3

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Names and synonyms

1 names

Ethanamine, 2-(3,4-dichlorophenoxy)-N,N-diethyl-

Work with Guayule

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

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

Elsewhere

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