chempirical

5-Bromo-3-iodo-2-methoxypyridine

C6H5BrINOCAS 578007-66-6313.92 g/mol

Open in Covalent MOL file
ONBrI
Aryl halideEther

Properties

Molecular formula
C6H5BrINO
Molar mass
313.92 g/mol
Exact mass
312.8599 Da
logP
2.46Crippen estimate
Polar surface area
22.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

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

Identifiers

CAS number
578007-66-6
SMILES
COC1=C(C=C(C=N1)Br)I
InChIKey
ZKVDYKJRRHTPLT-UHFFFAOYSA-N
InChI
InChI=1S/C6H5BrINO/c1-10-6-5(8)2-4(7)3-9-6/h2-3H,1H3

Weigh it out

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

Work with 5-Bromo-3-iodo-2-methoxypyridine

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

5-Bromo-2-methoxy-3-methylpyridine760207-87-266 % similar 3,5-Dibromo-2-methoxypyridine13472-60-163 % similar 2-Methoxy-3-fluoro-5-bromopyridine124432-70-859 % similar 2-Methoxy-3-chloro-5-bromopyridine848366-28-959 % similar 5-Bromo-2-methoxypyridine-3-carbaldehyde103058-87-354 % similar 5-Bromo-2-methoxy-3-(trifluoromethyl)pyridine1214377-42-054 % similar 5-Bromo-2-methoxy-3-nitropyridine152684-30-554 % similar 5-Bromo-3-methoxy-2-methylpyridine1150617-80-351 % similar

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

Elsewhere

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