- InChI
- InChI=1S/C17H23NO2/c1-18-7-6-17-5-3-2-4-12(17)14(18)8-11-9-15(19)16(20)10-13(11)17/h9-10,12,14,19-20H,2-8H2,1H3/t12?,14-,17-/m1/s1
- InChI Key
- SRBUIBKILLVEPZ-MRXJRLSOSA-N
- Formula
- C17H23NO2
- SMILES
-
CN1CCC23CCCCC2C1Cc1cc(O)c(O)cc
13 - Molecular Weight1
- 273.37
- 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 | -2.90 | Crippen Calculated Property | |
| logPoct/wat | 2.786 | Crippen Calculated Property | |
| McVol | 215.770 | ml/mol | McGowan Calculated Property |
| Inp | [2500.00; 2500.00] |
|
|
| Inp | 2500.00 | NIST | |
| Inp | 2500.00 | NIST |
Similar Compounds
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Sources
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