- InChI
- InChI=1S/C13H21NO3/c1-9(2)7-12(16)17-8-10-3-5-14-6-4-11(15)13(10)14/h7,10-11,13,15H,3-6,8H2,1-2H3/t10-,11-,13-/m0/s1
- InChI Key
- LBTHKJFPFBXYHC-GVXVVHGQSA-N
- Formula
- C13H21NO3
- SMILES
- CC(C)=CC(=O)OCC1CCN2CCC(O)C12
- Molecular Weight1
- 239.31
- Other Names
-
- 9-Senecioylplatynecine
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| log10WS | -1.59 | Crippen Calculated Property | |
| logPoct/wat | 0.951 | Crippen Calculated Property | |
| McVol | 191.300 | ml/mol | McGowan Calculated Property |
| Inp | [1935.00; 1935.00] |
|
|
| Inp | 1935.00 | NIST | |
| Inp | 1935.00 | NIST |
Similar Compounds
Find more compounds similar to 9-O-senecioylplatynecine.
Sources
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