chempirical

5-Bromo-2-methoxypyridine

C6H6BrNOCAS 13472-85-0188.02 g/mol

Open in Covalent MOL file
OBrN
Aryl halideEther

Properties

Molecular formula
C6H6BrNO
Molar mass
188.02 g/mol
Exact mass
186.9633 Da
Boiling point
65–70 °C (at 3.5 Torr)
logP
1.85Crippen estimate
Polar surface area
22.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
13472-85-0
SMILES
COc1ccc(Br)cn1
InChIKey
XADICJHFELMBGX-UHFFFAOYSA-N
InChI
InChI=1S/C6H6BrNO/c1-9-6-3-2-5(7)4-8-6/h2-4H,1H3

Weigh it out

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

Names and synonyms

4 names
  • Pyridine, 5-bromo-2-methoxy-
  • 2-Methoxy-5-bromopyridine
  • 3-Bromo-6-methoxypyridine
  • 5-Bromo-2-methyloxypyridine

Work with 5-Bromo-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-ethoxypyridine55849-30-458 % similar 5-Bromo-2-(1-methylethoxy)pyridine870521-31-658 % similar 5-Amino-2-methoxypyridine6628-77-953 % similar 2-Methoxy-5-(trifluoromethyl)pyridine175277-45-948 % similar 6-Methoxy-3-pyridinecarboxaldehyde65873-72-548 % similar 5-Bromo-2-methylpyridine3430-13-548 % similar 4-Bromoanisole104-92-746 % similar 2,5-Dibromopyridine624-28-246 % similar

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

Same formula

3-Amino-4-bromophenol100367-37-1 4-Bromo-2-methoxypyridine100367-39-3 2-Bromo-5-methoxypyridine105170-27-2 2-Amino-3-bromophenol116435-77-9 (2-Bromopyridin-4-yl)methanol118289-16-0 (6-Bromo-pyridin-3-yl)-methanol122306-01-8 4-Bromo-2-pyridinemethanol131747-45-0 3-Bromo-2-methoxypyridine13472-59-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook