chempirical

4-Bromo-8-methoxyquinoline

C10H8BrNOCAS 103028-31-5238.08 g/mol

Open in Covalent MOL file
ONBr
Aryl halideEther

Properties

Molecular formula
C10H8BrNO
Molar mass
238.08 g/mol
Exact mass
236.9789 Da
logP
3.01Crippen estimate
Polar surface area
22.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
103028-31-5
SMILES
COC1=CC=CC2=C(C=CN=C21)Br
InChIKey
ZTCUNVSNCQDTQR-UHFFFAOYSA-N
InChI
InChI=1S/C10H8BrNO/c1-13-9-4-2-3-7-8(11)5-6-12-10(7)9/h2-6H,1H3

Weigh it out

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

Work with 4-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-Methoxyquinoline938-33-053 % similar 1-Bromo-4-methoxynaphthalene5467-58-350 % similar 2-Bromoanisole578-57-448 % similar 5-Bromo-8-quinolinamine53472-18-746 % similar 2-Bromo-3-methoxypyridine24100-18-346 % similar 2-Bromo-1,3-dimethoxybenzene16932-45-944 % similar 2,4-Dichloro-8-methoxyquinazoline61948-60-544 % similar 3-Bromo-2-methoxypyridine13472-59-843 % similar

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

Same formula

6-Bromo-8-methoxyquinoline103028-32-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook