- InChI
- InChI=1S/C37H72O5Si3/c1-14-43(8,9)40-28-21-22-36(5)27(23-28)24-32(41-44(10,11)15-2)35-30-19-18-29(26(4)17-20-34(38)39-7)37(30,6)33(25-31(35)36)42-45(12,13)16-3/h26-33,35H,14-25H2,1-13H3/t26-,27-,28+,29-,30+,31+,32+,33+,35+,36+,37-/m0/s1
- InChI Key
- QIHGNFRQNAWOFU-BKLGZCQBSA-N
- Formula
- C37H72O5Si3
- SMILES
-
CC[Si](C)(C)OC1CCC2(C)C(C1)CC(
O[Si](C)(C)CC)C1C2CC(O[Si](C)( C)CC)C2(C)C(C(C)CCC(=O)OC)CCC1 2 - Molecular Weight1
- 681.22
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| log10WS | -3.57 | Crippen Calculated Property | |
| logPoct/wat | 10.285 | Crippen Calculated Property | |
| Inp | 3653.00 | NIST | |
| I | [3972.00; 3972.00] |
|
|
| I | 3972.00 | NIST | |
| I | 3972.00 | NIST |
Similar Compounds
Find more compounds similar to allo-Cholanic acid, 3«beta»,7«beta»,12«alpha»-trihydroxy, Me-DMES.
Sources
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