6-Bromo-8-methoxyquinoline

C10H8BrNOCAS 103028-32-6238.08 g/mol

Open in Covalent MOL file
OBrN
Aryl halideEther

Properties

Molecular formula
C10H8BrNO
Molar mass
238.08 g/mol
Exact mass
236.9789 Da
Boiling point
70–80 °C (at 24 Torr)
logP
3.01Crippen estimate
Polar surface area
22.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

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

Identifiers

CAS number
103028-32-6
SMILES
COc1cc(Br)cc2cccnc12
InChIKey
JXXVYYHNERBSBL-UHFFFAOYSA-N
InChI
InChI=1S/C10H8BrNO/c1-13-9-6-8(11)5-7-3-2-4-12-10(7)9/h2-6H,1H3

Weigh it out

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

Names and synonyms

1 names
  • Quinoline, 6-bromo-8-methoxy-

Work with 6-Bromo-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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

8-Methoxyquinoline938-33-060 % similar 3-Bromo-1,10-phenanthroline66127-01-353 % similar 6-Methoxy-8-aminoquinoline90-52-849 % similar 2-Bromo-3-methoxypyridine24100-18-349 % similar 1-Bromo-3,4,5-trimethoxybenzene2675-79-846 % similar 6-Bromoquinoline5332-25-245 % similar Bromoveratrole2859-78-144 % similar 2,3-Dimethoxypyridine52605-97-743 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Bromo-8-methoxyquinoline103028-31-5 4-(Bromomethyl)-1,2-dihydroquinolin-2-one4876-10-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook