Basic information
- CAS
110823-72-8- Standard SMILES
CCCCCCCCc1cnccn1- InChIKey
VEIAXROYVVCIER-UHFFFAOYSA-N- Molecular formula
- C12H20N2
- Average molar mass
- 192.3 g/mol
- Monoisotopic mass
- 192.16264865
Names & identifiers
- Preferred name
- Octylpyrazine
- IUPAC
- 2-octylpyrazine
Names & synonyms
Octylpyrazine110823-72-82-octylpyrazinePyrazine, octyl2-Subsituted pyrazine, 36SCHEMBL9752654SCHEMBL28842486BDBM84696DTXSID40335964VEIAXROYVVCIER-UHFFFAOYSA-NDB-089981
Database identifiers
- CAS
110823-72-8- PubChem CID
- 528151
- DTXSID
DTXSID40335964
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 125
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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