5-Bromo-2-ethoxypyridine

C₇H₈BrNOCAS 55849-30-4202.05 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
Melting point: 25 °C
logP: 2.24Crippen estimate
Polar surface area: 22.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Hazards

Danger

H302 Harmful if swallowed97.8% of notifiers
H315 Causes skin irritation97.8% of notifiers
H317 May cause an allergic skin reaction87% of notifiers
H318 Causes serious eye damage95.7% of notifiers
H335 May cause respiratory irritation95.7% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

55849-30-4

SMILES

CCOc1ccc(Br)cn1

InChIKey

WQXZKMUZWPUZGL-UHFFFAOYSA-N

InChI

InChI=1S/C7H8BrNO/c1-2-10-7-4-3-6(8)5-9-7/h3-5H,2H2,1H3

Weigh it out

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

Names and synonyms

3 names

Pyridine, 5-bromo-2-ethoxy-
3-Bromo-6-ethoxypyridine
6-Ethoxypyridin-3-yl bromide

Work with 5-Bromo-2-ethoxypyridine

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-methoxypyridine13472-85-058 % similar 6-Ethoxypyridin-3-amine52025-34-058 % similar 2-Benzyloxy-5-bromopyridine83664-33-957 % similar 5-Bromo-2-(1-methylethoxy)pyridine870521-31-653 % similar (6-Ethoxypyridin-3-yl)boronic acid612845-44-053 % similar 4-Bromophenetole588-96-552 % similar 2-Ethoxy-5-nitropyridine31594-45-349 % similar Ethyl 5-bromopicolinate77199-09-849 % 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 5-Bromo-2-methoxy-4-methylpyridine164513-39-7 4-Bromo-3-methoxyaniline19056-40-7 3-Bromo-4-methoxyaniline19056-41-8 3-Bromo-2-ethoxypyridine57883-25-7 4-Bromo-2-methoxybenzenamine59557-91-4

Elsewhere

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