5-Bromo-2-methoxy-4-methylpyridine

C7H8BrNOCAS 164513-39-7202.05 g/mol

Open in Covalent MOL file
NBrO
Aryl halideEther

Properties

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

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 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
164513-39-7
SMILES
CC1=CC(=NC=C1Br)OC
InChIKey
HTBPXLJKMNBQMS-UHFFFAOYSA-N
InChI
InChI=1S/C7H8BrNO/c1-5-3-7(10-2)9-4-6(5)8/h3-4H,1-2H3

Weigh it out

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Work with 5-Bromo-2-methoxy-4-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

2,5-Dibromo-4-methylpyridine3430-26-055 % similar 5-Bromo-2-chloro-4-methylpyridine778611-64-652 % similar 5-Bromo-2-fluoro-4-methyl-pyridine864830-16-052 % similar 2-Amino-5-bromo-4-methylpyridine98198-48-252 % similar 2-Methoxy-4-methyl-5-nitropyridine6635-90-149 % similar 5-Bromo-4-methyl-pyridine-2-carbonitrile886364-86-947 % similar 4-Bromo-2-methoxypyridine100367-39-347 % similar 4-Bromo-3-methylanisole27060-75-947 % 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-6-picoline126717-59-7 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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