chempirical

3-Ethyl-4-methylpyridine

C8H11NCAS 529-21-5121.18 g/mol

Open in Covalent MOL file
N

Properties

Molecular formula
C8H11N
Molar mass
121.18 g/mol
Exact mass
121.0891 Da
Density
0.9458 g/mL (at 20 °C)
Boiling point
198 °C
logP
1.95Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
529-21-5
SMILES
CCc1cnccc1C
InChIKey
JDQNYWYMNFRKNQ-UHFFFAOYSA-N
InChI
InChI=1S/C8H11N/c1-3-8-6-9-5-4-7(8)2/h4-6H,3H2,1-2H3

Weigh it out

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

Names and synonyms

8 names
  • Pyridine, 3-ethyl-4-methyl-
  • 4-Picoline, 3-ethyl-
  • β-Collidine
  • β-Ethyl-γ-methylpyridine
  • 3-Ethyl-γ-picoline
  • 3-Ethyl-4-picoline
  • 4-Methyl-3-ethylpyridine
  • NSC 62016

Work with 3-Ethyl-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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3,4-Dimethylpyridine583-58-454 % similar 1-Ethyl-2-methylbenzene611-14-350 % similar 3-Hydroxy-4-methylpyridine1121-19-347 % similar 3-Bromo-4-methylpyridine3430-22-647 % similar 3-Amino-4-methylpyridine3430-27-147 % similar 3-Chloro-4-methylpyridine72093-04-047 % similar 2-Ethylpyrazine13925-00-343 % similar 4-Methyl-3-nitropyridine5832-44-043 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Methylbenzylamine100-81-2 N-Methylbenzylamine103-67-3 N-Ethylaniline103-69-5 4-Methylbenzylamine104-84-7 5-Ethyl-2-methylpyridine104-90-5 3,5-Xylidine108-69-0 2,4,6-Trimethylpyridine108-75-8 4-Propylpyridine1122-81-2

Elsewhere

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