- InChI
- InChI=1S/C20H29F3N2O6Si/c1-12-10-25(18(28)24-16(12)26)15-9-13(31-17(27)20(21,22)23)14(30-15)11-29-32(19(2,3)4)7-5-6-8-32/h10,13-15H,5-9,11H2,1-4H3,(H,24,26,28)/t13?,14-,15-/m1/s1
- InChI Key
- ONOPPLTUARSEEI-JVIGXAJISA-N
- Formula
- C20H29F3N2O6Si
- SMILES
-
Cc1cn(C2CC(OC(=O)C(F)(F)F)C(CO
[Si]3(C(C)(C)C)CCCC3)O2)c(=O)[ nH]c1=O - Molecular Weight1
- 478.53
- 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 | 0.8206 | Relay (1.0) Calculated Property | |
| ΔfG° | -897.54 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1727.20 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 127.58 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.00 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.681 | Crippen Calculated Property | |
| Pc | 815.48 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2684.00 | NIST | |
| Tboil | 686.54 | K | Relay (1.0) Calculated Property |
| Tc | 935.66 | K | Relay (1.0) Calculated Property |
| Tfus | 438.01 | K | Relay (1.0) Calculated Property |
| Vc | 1.206 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Thymidine, 3'-O-TFA, 5'-O-cyclotetramethylene-tertbutylsilyl.
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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