chempirical

Isobutylpyrazine

C8H12N2CAS 29460-92-2136.20 g/mol

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Properties

Molecular formula
C8H12N2
Molar mass
136.20 g/mol
Exact mass
136.1000 Da
logP
1.68Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
29460-92-2
SMILES
CC(C)Cc1cnccn1
InChIKey
YAIMUUJMEBJXAA-UHFFFAOYSA-N
InChI
InChI=1S/C8H12N2/c1-7(2)5-8-6-9-3-4-10-8/h3-4,6-7H,5H2,1-2H3

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

Names and synonyms

6 names
  • Pyrazine, 2-(2-methylpropyl)-
  • Pyrazine, isobutyl-
  • Pyrazine, (2-methylpropyl)-
  • 2-(2-Methylpropyl)pyrazine
  • 2-Isobutylpyrazine
  • 2-Methylpropylpyrazine

Work with Isobutylpyrazine

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-Ethylpyrazine13925-00-354 % similar 2-Isobutylpyridine6304-24-153 % similar Propylpyrazine18138-03-950 % similar Pyrazinemethanethiol59021-02-248 % similar 2-Pyrazinemethanol6705-33-548 % similar Pyrazineethanethiol35250-53-445 % similar 2-Isobutyl-3-methylpyrazine13925-06-944 % similar Isopropylpyrazine29460-90-043 % similar

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

Same formula

Tetramethylpyrazine1124-11-4 2,5-Diethylpyrazine13238-84-1 2-(4-Aminophenyl)ethylamine13472-00-9 2-Ethyl-3,5-dimethylpyrazine13925-07-0 M-Xylylenediamine1477-55-0 2,3-Diethylpyrazine15707-24-1 2,3-Dimethyl-5-ethylpyrazine15707-34-3 2-Methyl-3-propylpyrazine15986-80-8

Elsewhere

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