2-Bromo-4-ethylpyridine

C7H8BrNCAS 54453-91-7186.05 g/mol

Open in Covalent MOL file
NBr
Aryl halide

Properties

Molecular formula
C7H8BrN
Molar mass
186.05 g/mol
Exact mass
184.9840 Da
logP
2.41Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 40 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
54453-91-7
SMILES
CCC1=CC(=NC=C1)Br
InChIKey
JMDIWBIWPAAWHP-UHFFFAOYSA-N
InChI
InChI=1S/C7H8BrN/c1-2-6-3-4-9-7(8)5-6/h3-5H,2H2,1H3

Weigh it out

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

Work with 2-Bromo-4-ethylpyridine

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-Bromopyridin-4-yl)methanol118289-16-060 % similar 2-Bromo-4-(1-piperidinylmethyl)pyridine88046-02-051 % similar 2-Bromo-4-methylpyridine4926-28-750 % similar 2,4-Dibromopyridine58530-53-348 % similar 4-Ethylpyridine536-75-446 % similar 2-Bromo-4-tert-butylpyridine50488-34-145 % similar 2-Bromo-4-iodopyridine100523-96-445 % similar 2-Bromo-4-chloropyridine22918-01-045 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Bromobenzylamine10269-01-9 4-Bromo-2,3-dimethylpyridine259807-91-5 5-Bromo-2,3-dimethylpyridine27063-90-7 3-Bromo-2,4-dimethylpyridine27063-93-0 3-Bromo-2,6-dimethylpyridine3430-31-7 5-Bromo-o-toluidine39478-78-9 2-Bromobenzylamine3959-05-5 4-Bromobenzenemethanamine3959-07-7

Elsewhere

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