2,3-Dimethylpyrazine
Properties
- Molecular formula
- C6H8N2
- Molar mass
- 108.14 g/mol
- Exact mass
- 108.0687 Da
- Density
- 1.01 g/mL
- Boiling point
- 156 °C
- logP
- 1.09Crippen estimate
- Polar surface area
- 25.8 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 0
Hazards
Warning
- H226 Flammable liquid and vapor100% of notifiers
- H302 Harmful if swallowed> 99.9% of notifiers
Aggregated from 1,668 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P317, P303+P361+P353, P330, P370+P378, P403+P235, P501
Identifiers
CAS number
5910-89-4SMILES
Cc1nccnc1CInChIKey
OXQOBQJCDNLAPO-UHFFFAOYSA-NInChI
InChI=1S/C6H8N2/c1-5-6(2)8-4-3-7-5/h3-4H,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
1 names
- Pyrazine, 2,3-dimethyl-
Work with 2,3-Dimethylpyrazine
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-Methyl-2-pyrazinamine19838-08-558 % similar
2-Chloro-3-methylpyrazine95-58-958 % similar
2-Methoxy-3-methylpyrazine2847-30-555 % similar
2-Ethyl-3-methylpyrazine15707-23-052 % similar
2-Methyl-3-(methylthio)pyrazine2882-20-452 % similar
Methyl(methylthio)pyrazine67952-65-252 % similar
2-Methyl-3-propylpyrazine15986-80-848 % similar
2-Ethoxy-3-methylpyrazine32737-14-748 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.