7-(Benzyloxy)-4-chloroquinoline

C₁₆H₁₂ClNOCAS 178984-56-0269.73 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₁₆H₁₂ClNO
Molar mass: 269.73 g/mol
Exact mass: 269.0607 Da
logP: 4.47Crippen estimate
Polar surface area: 22.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number

178984-56-0

SMILES

C1=CC=C(C=C1)COC2=CC3=NC=CC(=C3C=C2)Cl

InChIKey

TXHLONYFVBSHDY-UHFFFAOYSA-N

InChI

InChI=1S/C16H12ClNO/c17-15-8-9-18-16-10-13(6-7-14(15)16)19-11-12-4-2-1-3-5-12/h1-10H,11H2

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Names and synonyms

1 names

7-Benzyloxy-4-chloroquinoline

Work with 7-(Benzyloxy)-4-chloroquinoline

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

7-Benzyloxy-4-chloro-6-methoxy-quinoline286371-49-160 % similar 4-Chloro-7-methoxyquinoline68500-37-857 % similar 4,7-Dichloroquinoline86-98-653 % similar 1,3-Dibenzyloxybenzene3769-42-450 % similar 7-Bromo-4-chloroquinoline75090-52-750 % similar 4-Benzyloxychlorobenzene7700-27-850 % similar 2-Amino-4-(benzyloxy)pyridine85333-26-250 % similar 4-Chloroquinoline611-35-849 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Chloro-7-methoxy-2-phenylquinoline189816-05-5

Elsewhere

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