- InChI
- InChI=1S/C34H48N4O2Si3/c1-19-20(2)28-16-32-25(7)26(8)34-18-30-22(4)21(3)29(36-30)17-33-24(6)23(5)31(15-27(19)35-28)37(33)43(38(32)34,39-41(9,10)11)40-42(12,13)14/h15-18,35-36H,1-14H3/b27-15-,28-16-,29-17-,30-18-,31-15-,32-16-,33-17-,34-18-
- InChI Key
- OQQNEVKISXVESL-YLPLBUAGSA-N
- Formula
- C34H48N4O2Si3
- SMILES
-
Cc1c2[nH]c(c1C)C=c1c(C)c(C)c3n
1[Si](O[Si](C)(C)C)(O[Si](C)(C )C)n1c(c(C)c(C)c1=Cc1[nH]c(c(C )c1C)C=3)=C2 - Molecular Weight1
- 629.03
- 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.
- 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 | 1.1045 | Relay (1.0) Calculated Property | |
| ΔfG° | 476.24 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -375.75 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 157.18 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 5.79 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.926 | Crippen Calculated Property | |
| Inp | [3200.00; 3200.00] |
|
|
| Inp | 3200.00 | NIST | |
| Inp | 3200.00 | NIST | |
| Tboil | 814.30 | K | Relay (1.0) Calculated Property |
| Tc | 1307.35 | K | Relay (1.0) Calculated Property |
| Tfus | 614.02 | K | Relay (1.0) Calculated Property |
| Vc | 1.942 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Silica-octamethylporphyrine complex, bis-OTMS.
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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