- InChI
- InChI=1S/C13H21NO3/c1-3-13(2,16)12(15)17-9-10-6-8-14-7-4-5-11(10)14/h3,10-11,16H,1,4-9H2,2H3/t10-,11-,13+/m1/s1
- InChI Key
- JNRQYFRCQACATM-WZRBSPASSA-N
- Formula
- C13H21NO3
- SMILES
- C=CC(C)(O)C(=O)OCC1CCN2CCCC12
- Molecular Weight1
- 239.31
- 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 | [1720.00; 1720.00] |
|
|
| Inp | 1720.00 | NIST | |
| Inp | 1720.00 | NIST |
Similar Compounds
Find more compounds similar to Minalobine C.
Sources
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