Basic information
- CAS
846031-97-8- Standard SMILES
CCc1cccc(N2CCNCC2)n1- InChIKey
BHERUCWARRWLPH-UHFFFAOYSA-N- Molecular formula
- C11H17N3
- Average molar mass
- 191.27 g/mol
- Monoisotopic mass
- 191.14224756
Names & identifiers
- Preferred name
- 1-(6-Ethylpyridin-2-YL)piperazine
- IUPAC
- 1-(6-ethyl-2-pyridinyl)piperazine
- English name
- Piperazine, 1-(6-ethyl-2-pyridinyl)- (9CI)
- Molecular formula
- C11H17N3
- Molecular weight
- 191.27
Names & synonyms
846031-97-81-(6-ETHYLPYRIDIN-2-YL)PIPERAZINESCHEMBL5217823DTXSID60610528BHERUCWARRWLPH-UHFFFAOYSA-N1-(6-ethyl-pyridin-2-yl)-piperazinePiperazine, 1-(6-ethyl-2-pyridinyl)-DB-327210Piperazine, 1-(6-ethyl-2-pyridinyl)- (9CI)
Database identifiers
- CAS
846031-97-8- PubChem CID
- 21073176
- DTXSID
DTXSID60610528
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 166
Physicochemical properties
- Boiling point
- 343.7 · 343.7±37.0 °C(Predicted)
- Density
- 1.04 · 1.040±0.06 g/cm3(Predicted)
- pka
- 9.09 · 9.09±0.19(Predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
2 records
Compound notes
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