3-Bromo-2-isopropoxypyridine

C8H10BrNOCAS 717843-55-5216.08 g/mol

Open in Covalent MOL file
ONBr
Aryl halideEther

Properties

Molecular formula
C8H10BrNO
Molar mass
216.08 g/mol
Exact mass
214.9946 Da
logP
2.63Crippen estimate
Polar surface area
22.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
717843-55-5
SMILES
CC(C)OC1=C(C=CC=N1)Br
InChIKey
UHQQSDAMSSVOQU-UHFFFAOYSA-N
InChI
InChI=1S/C8H10BrNO/c1-6(2)11-8-7(9)4-3-5-10-8/h3-6H,1-2H3

Weigh it out

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

Work with 3-Bromo-2-isopropoxypyridine

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

3-Bromo-2-methoxypyridine13472-59-858 % similar 2-Isopropoxy-pyridine-3-carbaldehyde885278-10-456 % similar 3-Bromo-2-ethoxypyridine57883-25-753 % similar 1-Bromo-2-(1-methylethoxy)benzene701-07-550 % similar 3-Bromo-2-methylpyridine38749-79-048 % similar 2,3-Dibromopyridine13534-89-942 % similar 2,3-Dimethoxypyridine52605-97-741 % similar 3-Bromo-2(1H)-pyridinone13466-43-839 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Bromo-3-ethoxybenzenamine125756-95-8 1-(2-Oxopropyl)pyridinium bromide17282-41-6 2-(6-Bromo-3-pyridyl)-2-propanol477252-29-2 2-(6-Bromopyridin-2-yl)propan-2-ol638218-78-7 5-Bromo-2-(1-methylethoxy)pyridine870521-31-6

Elsewhere

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