5-Bromo-2-methoxy-6-picoline

C₇H₈BrNOCAS 126717-59-7202.05 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

Danger

H302 Harmful if swallowed95.3% of notifiers
H318 Causes serious eye damage93% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, P501

Identifiers

CAS number

126717-59-7

SMILES

CC1=C(C=CC(=N1)OC)Br

InChIKey

VWNXCCTWVAQAPL-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

1 names

3-Bromo-6-methoxy-2-methylpyridine

Work with 5-Bromo-2-methoxy-6-picoline

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-chloro-6-methoxypyridine777931-67-659 % similar 6-Methoxy-2-methylpyridin-3-amine52090-56-958 % similar 5-Fluoro-2-methoxy-6-picoline375368-86-856 % similar 3-Bromo-2,6-dimethylpyridine3430-31-753 % similar 3,6-Dibromo-2-methylpyridine39919-65-853 % similar 3-Amino-6-methoxy-2-picoline hcl320577-63-753 % similar 3-Bromo-6-chloro-2-methylpyridine132606-40-750 % similar 3-Bromo-6-fluoro-2-methylpyridine375368-83-550 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Bromo-3-methoxy-2-methylpyridine1150617-80-3 2-Amino-6-bromoanisole116557-46-1 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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