4-Chloro-8-methoxy-2-methylquinoline

C₁₁H₁₀ClNOCAS 64951-58-2207.66 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₁₁H₁₀ClNO
Molar mass: 207.66 g/mol
Exact mass: 207.0451 Da
logP: 3.21Crippen estimate
Polar surface area: 22.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Hazards

Danger

H301 Toxic if swallowed90.9% of notifiers
H318 Causes serious eye damage90.9% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, P501

Identifiers

CAS number

64951-58-2

SMILES

CC1=CC(=C2C=CC=C(C2=N1)OC)Cl

InChIKey

RHSCPZBPNUZBOA-UHFFFAOYSA-N

InChI

InChI=1S/C11H10ClNO/c1-7-6-9(12)8-4-3-5-10(14-2)11(8)13-7/h3-6H,1-2H3

Weigh it out

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

Work with 4-Chloro-8-methoxy-2-methylquinoline

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-Chloro-2,8-dimethylquinoline32314-39-962 % similar 4-Chloro-2-methylquinoline4295-06-153 % similar 2,4-Dichloro-8-methoxyquinazoline61948-60-553 % similar 1-Chloro-3-methoxy-2-methylbenzene3260-88-649 % similar 2-Chloroanisole766-51-849 % similar 2,3-Dichloroanisole1984-59-446 % similar Chlorquinaldol72-80-044 % similar 3-Chloro-2-fluoroanisole261762-56-544 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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