- InChI
- InChI=1S/C12H26O4Si2/c1-17(2,3)15-11(13)9-7-8-10-12(14)16-18(4,5)6/h7-10H2,1-6H3
- InChI Key
- DVGSOFSBBKDKRU-UHFFFAOYSA-N
- Formula
- C12H26O4Si2
- SMILES
-
C[Si](C)(C)OC(=O)CCCCC(=O)O[Si
](C)(C)C - Molecular Weight1
- 290.50
- CAS
- 18105-31-2
- Other Names
-
- Adipic acid, bis(trimethylsilyl) ester
- Bis(trimethylsilyl) adipate
- Adipic acid (tms)
- Adipic acid, di(trimethylsilyl) ester
- Bis(trimethylsilyl) hexanedioate
- Adipate, bis-TMS
- Adipic acid, (2TMS)
- Adipic acid, bis-TMS
- Adipic acid, diTMS
- Hexanedioic acid, di-TMS ester
- Hexanedioic acid, bis-TMS ester
- Hexanedioic acid, 1,6-bis(trimethylsilyl) ester
- Adipate, TMS
- Hexanedioic acid, TMS
- Hexanedioic acid, 2tms derivative
- 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 | 0.7171 | Relay (... Calculated Property | |
| ΔfG° | -439.29 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1128.17 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 68.92 | kJ/mol | Relay (... Calculated Property |
| IE | 9.91 | eV | Relay (... Calculated Property |
| log10WS | -2.53 | Relay (... Calculated Property | |
| logPoct/wat | 3.303 | Crippen Calculated Property | |
| Pc | 1212.67 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1490.00; 1525.00] |
|
|
| Inp | 1490.00 | NIST | |
| Inp | 1510.00 | NIST | |
| Inp | 1525.00 | NIST | |
| Inp | 1510.00 | NIST | |
| Inp | 1498.00 | NIST | |
| Inp | 1504.00 | NIST | |
| Inp | 1515.00 | NIST | |
| Inp | 1498.00 | NIST | |
| Inp | 1514.00 | NIST | |
| Inp | 1514.00 | NIST | |
| Inp | 1499.00 | NIST | |
| Inp | 1502.00 | NIST | |
| Inp | 1492.20 | NIST | |
| Inp | 1497.00 | NIST | |
| Inp | 1499.00 | NIST | |
| Inp | 1514.00 | NIST | |
| Inp | 1522.00 | NIST | |
| Inp | 1516.00 | NIST | |
| Inp | 1502.00 | NIST | |
| Inp | 1490.00 | NIST | |
| Inp | 1510.00 | NIST | |
| Inp | 1515.00 | NIST | |
| Inp | 1502.00 | NIST | |
| Inp | 1514.00 | NIST | |
| Inp | 1492.20 | NIST | |
| Tboil | 519.73 | K | Relay (... Calculated Property |
| Tc | 683.07 | K | Relay (... Calculated Property |
| Tfus | 284.79 | K | Relay (... Calculated Property |
| Vc | 0.970 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Hexanedioic acid, bis(trimethylsilyl) 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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