Basic information
- CAS
69309-47-3- Standard SMILES
C=CC[N+]1(CCC(C)CCCC(C)C)CCCCC1- InChIKey
NTHCPJMKRGXODE-UHFFFAOYSA-N- Molecular formula
- C18H36N+
- Average molar mass
- 266.5 g/mol
- Monoisotopic mass
- 266.28477515
Overview
Piproctanyl is a member of piperidines.
Names & identifiers
- Preferred name
- Piproctanyl
- IUPAC
- 1-(3,7-dimethyloctyl)-1-prop-2-enylpiperidin-1-ium
- English name
- 1-Allyl-1-(3,7-dimethyloctyl)piperidinium
- Molecular formula
- C18H36N+
- Molecular weight
- 266.49
Names & synonyms
PiproctanylPiproctanyl [ISO]69309-47-31-(3,7-dimethyloctyl)-1-prop-2-enylpiperidin-1-iumUNII-G08Z298WTVG08Z298WTVPIPROCTANYLIUMPIPROCTANYL IONPIPROCTANYL CATIONPIPROCTANYLIUM IONPIPROCTANYLIUM CATIONSCHEMBL121249
Show more names
1-Allyl-1-(3,7-dimethyloctyl)piperidinium
CHEBI:82253DTXSID608607031-(3,7-Dimethyloctyl)-1-(prop-2-en-1-yl)piperidin-1-iumC19133Q27155841PIPERIDINIUM, 1-(3,7-DIMETHYLOCTYL)-1-(2-PROPEN-1-YL)-
Database identifiers
- CAS
69309-47-3- PubChem CID
- 92514
- DTXSID
DTXSID60860703- ChEBI
CHEBI:82253- UNII
- G08Z298WTV
- Nikkaji
- J19.086A
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 1
- Complexity
- 238
Physicochemical properties
- FDA UNII
- 8 Z298WTV · G08Z298WTV
Chemistry & industry
Additional notes
DefinitionChEBI: Piproctanyl is a member of piperidines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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