5-Bromo-3-methoxy-2-methylpyridine

C₇H₈BrNOCAS 1150617-80-3202.05 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₇H₈BrNO
Molar mass: 202.05 g/mol
Exact mass: 200.9789 Da
logP: 2.16Crippen estimate
Polar surface area: 22.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1150617-80-3

SMILES

COc1cc(Br)cnc1C

InChIKey

FAWLCNSUYFGYMF-UHFFFAOYSA-N

InChI

InChI=1S/C7H8BrNO/c1-5-7(10-2)3-6(8)4-9-5/h3-4H,1-2H3

Weigh it out

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

Names and synonyms

1 names

Pyridine, 5-bromo-3-methoxy-2-methyl-

Work with 5-Bromo-3-methoxy-2-methylpyridine

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-chloro-3-methoxypyridine286947-03-361 % similar 5-Bromo-3-methoxypyridin-2-amine42409-58-561 % similar 5-Bromo-2-methoxy-3-methylpyridine760207-87-258 % similar 5-Bromo-2-methyl-3-pyridinamine914358-73-956 % similar 5-Bromo-2,3-dimethylpyridine27063-90-755 % similar 3,5-Dibromo-2-methoxypyridine13472-60-155 % similar 5-Bromo-3-hydroxy-2-methylpyridine91420-25-652 % similar 5-Bromo-3-chloro-2-methylpyridine914358-72-852 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Amino-6-bromoanisole116557-46-1 5-Bromo-2-methoxy-6-picoline126717-59-7 5-Bromo-2-methoxy-4-methylpyridine164513-39-7 4-Bromo-3-methoxyaniline19056-40-7 3-Bromo-4-methoxyaniline19056-41-8 5-Bromo-2-ethoxypyridine55849-30-4 3-Bromo-2-ethoxypyridine57883-25-7 4-Bromo-2-methoxybenzenamine59557-91-4

Elsewhere

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