8-Methoxyquinoline

C₁₀H₉NOCAS 938-33-0159.19 g/mol

Open in Covalent MOL file

Ether

Properties

Molecular formula: C₁₀H₉NO
Molar mass: 159.19 g/mol
Exact mass: 159.0684 Da
Density: 1.012 g/mL (at 20 °C)
Melting point: 49.5 °C
Boiling point: 283 °C
logP: 2.24Crippen estimate
Polar surface area: 22.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Hazards

Danger

H301 Toxic if swallowed33.3% of notifiers
H302 Harmful if swallowed33.3% of notifiers
H312 Harmful in contact with skin66.7% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled33.3% of notifiers
H335 May cause respiratory irritation66.7% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

938-33-0

SMILES

COc1cccc2cccnc12

InChIKey

ZLKGGEBOALGXJZ-UHFFFAOYSA-N

InChI

InChI=1S/C10H9NO/c1-12-9-6-2-4-8-5-3-7-11-10(8)9/h2-7H,1H3

Weigh it out

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

Names and synonyms

1 names

Quinoline, 8-methoxy-

Work with 8-Methoxyquinoline

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

6-Bromo-8-methoxyquinoline103028-32-660 % similar 2-Chloro-3-methoxypyridine52605-96-658 % similar 2,3-Dimethoxypyridine52605-97-757 % similar 8-Acetoxyquinoline2598-29-056 % similar 5-Methoxyquinoline6931-19-755 % similar 3-Methoxy-2(1H)-pyridinone20928-63-653 % similar 2-Bromo-3-methoxypyridine24100-18-353 % similar 4-Bromo-8-methoxyquinoline103028-31-553 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

6-Quinolinemethanol100516-88-9 8-Amino-2-naphthol118-46-7 2-Quinolinemethanol1780-17-2 3-Methylquinoline N-oxide1873-55-8 1-Methylindole-3-carboxaldehyde19012-03-4 Indole-3-acetaldehyde2591-98-2 1-Isoquinolinemethanol27311-63-3 1-Amino-2-naphthol2834-92-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook