Basic information
- CAS
40790-18-9- Standard SMILES
CCCc1nccnc1CC- InChIKey
JRSLPATZSWKFDA-UHFFFAOYSA-N- Molecular formula
- C9H14N2
- Average molar mass
- 150.22 g/mol
Names & identifiers
- Preferred name
- Ethylpropylpyrazine
- IUPAC
- 2-ethyl-3-propylpyrazine
- English name
- 2-Ethyl-3-propylpyrazine
- Molecular formula
- C9H14N2
- Molecular weight
- 150.22
Names & synonyms
ethylpropylpyrazineSCHEMBL18641591SCHEMBL293648872-Ethyl-3-propylpyrazinePyrazine, 2-ethyl-3-propyl-
Database identifiers
- CAS
40790-18-9- Nikkaji
- J410.663F
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 104
Physicochemical properties
- Boiling point
- 66 · 66-67 °C(Press: 16 Torr)
- Density
- 0.95 · 0.950±0.06 g/cm3(Predicted)
- pka
- 1.94 · 1.94±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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