2,5-Dimethyl-3,6-dipropylpyrazine
Basic information
- CAS
40790-33-8- Standard SMILES
CCCc1nc(C)c(CCC)nc1C- InChIKey
UNTGFIAQBXNWEA-UHFFFAOYSA-N- Molecular formula
- C12H20N2
- Average molar mass
- 192.3 g/mol
- Monoisotopic mass
- 192.16264865
Names & identifiers
- Preferred name
- 2,5-Dimethyl-3,6-dipropylpyrazine
- IUPAC
- 2,5-dimethyl-3,6-dipropylpyrazine
Names & synonyms
2,5-Dimethyl-3,6-dipropylpyrazine40790-33-8DTXSID20344377RefChem:247579DTXCID802954523,6-Dipropyl-2,5-dimethylpyrazineSCHEMBL113295922,5-dimethyl-3,6-dipropyl-pyrazine2,5-Dimethyl-3,6-dipropylpyrazine #
Database identifiers
- CAS
40790-33-8- PubChem CID
- 596333
- DTXSID
DTXSID20344377- Nikkaji
- J599.867K
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 140
Related reactions
11 records
Compound notes
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