- InChI
- InChI=1S/C25H54N4O5Si4/c1-14-15-18-31-27-25-26-21(28-35(2,3)4)16-17-29(25)24-23(34-38(11,12)13)22(33-37(8,9)10)20(19-30-24)32-36(5,6)7/h16-17,20,22-24H,14-15,18-19H2,1-13H3,(H,26,27,28)/t20-,22?,23?,24+/m0/s1
- InChI Key
- ZHNKLURKPSWQHL-XTKMRXRUSA-N
- Formula
- C25H54N4O5Si4
- SMILES
-
CCCCON=c1nc(N[Si](C)(C)C)ccn1C
1OCC(O[Si](C)(C)C)C(O[Si](C)(C )C)C1O[Si](C)(C)C - Molecular Weight1
- 603.06
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 1.0539 | Relay (... Calculated Property | |
| ΔfG° | 53.17 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1143.42 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 114.06 | kJ/mol | Relay (... Calculated Property |
| IE | 7.80 | eV | Relay (... Calculated Property |
| log10WS | -5.34 | Relay (... Calculated Property | |
| logPoct/wat | 5.951 | Crippen Calculated Property | |
| Pc | -354.28 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2715.00; 2715.00] |
|
|
| Inp | 2715.00 | NIST | |
| Inp | 2715.00 | NIST | |
| Tboil | 707.91 | K | Relay (... Calculated Property |
| Tc | 948.40 | K | Relay (... Calculated Property |
| Tfus | 308.77 | K | Relay (... Calculated Property |
| Vc | 1.886 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Cytosine arabinoside, buto-oxime-TMS derivative.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- NIST Webbook
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