- InChI
- InChI=1S/C18H29NO4Si/c1-13(2)12-22-17(21)19-15-10-8-14(9-11-15)16(20)23-24(6,7)18(3,4)5/h8-11,13H,12H2,1-7H3,(H,19,21)
- InChI Key
- HCVZRZNLNUFCIP-UHFFFAOYSA-N
- Formula
- C18H29NO4Si
- SMILES
-
CC(C)COC(=O)Nc1ccc(C(=O)O[Si](
C)(C)C(C)(C)C)cc1 - Molecular Weight1
- 351.51
- 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 | 0.8575 | Relay (1.0) Calculated Property | |
| ΔfG° | -228.83 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -924.54 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 90.36 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.37 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.50 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.053 | Crippen Calculated Property | |
| Pc | 1511.70 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2463.00; 2463.00] |
|
|
| Inp | 2463.00 | NIST | |
| Inp | 2463.00 | NIST | |
| Tboil | 627.36 | K | Relay (1.0) Calculated Property |
| Tc | 871.42 | K | Relay (1.0) Calculated Property |
| Tfus | 378.67 | K | Relay (1.0) Calculated Property |
| Vc | 1.047 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to p-Aminobenzoic acid, N-isoBOC TBDMS.
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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