- InChI
- InChI=1S/C23H22O3Si/c1-27(2,16-17-10-4-3-5-11-17)26-23(24)22-18-12-6-8-14-20(18)25-21-15-9-7-13-19(21)22/h3-15,22H,16H2,1-2H3
- InChI Key
- IOSGUVMUCBTDRT-UHFFFAOYSA-N
- Formula
- C23H22O3Si
- SMILES
-
C[Si](C)(Cc1ccccc1)OC(=O)C1c2c
cccc2Oc2ccccc21 - Molecular Weight1
- 374.50
- 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 | 0.7020 | Relay (1.0) Calculated Property | |
| ΔfG° | 34.56 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -322.88 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 111.04 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.62 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.71 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.454 | Crippen Calculated Property | |
| Pc | 1533.37 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2625.00 | NIST | |
| Tboil | 701.44 | K | Relay (1.0) Calculated Property |
| Tc | 1018.93 | K | Relay (1.0) Calculated Property |
| Tfus | 397.56 | K | Relay (1.0) Calculated Property |
| Vc | 1.069 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Xanthene-9-carboxylic acid, benzyldimethylsilyl ester.
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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