- InChI
- InChI=1S/C16H32O3/c1-6-7-8-9-10-11-12-15(17)19-14(2)13-18-16(3,4)5/h14H,6-13H2,1-5H3
- InChI Key
- FGLVSVRSIWXAKB-UHFFFAOYSA-N
- Formula
- C16H32O3
- SMILES
- CCCCCCCCC(=O)OC(C)COC(C)(C)C
- Molecular Weight1
- 272.42
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion 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.
- McVol : McGowan's characteristic volume (ml/mol).
- 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 | 0.7516 | Relay (... Calculated Property | |
| ΔfG° | -254.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -853.31 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 30.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.52 | kJ/mol | Relay (... Calculated Property |
| IE | 9.48 | eV | Relay (... Calculated Property |
| log10WS | -4.07 | Relay (... Calculated Property | |
| logPoct/wat | 4.484 | Crippen Calculated Property | |
| McVol | 249.610 | ml/mol | McGowan Calculated Property |
| Pc | 1373.78 | kPa | Joback Calculated Property |
| Inp | 1669.00 | NIST | |
| Tboil | 540.47 | K | Relay (... Calculated Property |
| Tc | 706.35 | K | Relay (... Calculated Property |
| Tfus | 246.53 | K | Relay (... Calculated Property |
| Vc | 0.962 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [709.45; 807.32] | J/mol×K | [660.52; 836.93] | 
|
| Cp,gas | 709.45 | J/mol×K | 660.52 | Joback Calculated Property |
| Cp,gas | 727.89 | J/mol×K | 689.92 | Joback Calculated Property |
| Cp,gas | 745.45 | J/mol×K | 719.32 | Joback Calculated Property |
| Cp,gas | 762.16 | J/mol×K | 748.73 | Joback Calculated Property |
| Cp,gas | 778.02 | J/mol×K | 778.13 | Joback Calculated Property |
| Cp,gas | 793.07 | J/mol×K | 807.53 | Joback Calculated Property |
| Cp,gas | 807.32 | J/mol×K | 836.93 | Joback Calculated Property |
| η | [0.0000752; 0.0023309] | Pa×s | [351.89; 660.52] |
|
| η | 0.0023309 | Pa×s | 351.89 | Joback Calculated Property |
| η | 0.0009131 | Pa×s | 403.33 | Joback Calculated Property |
| η | 0.0004422 | Pa×s | 454.77 | Joback Calculated Property |
| η | 0.0002481 | Pa×s | 506.20 | Joback Calculated Property |
| η | 0.0001549 | Pa×s | 557.64 | Joback Calculated Property |
| η | 0.0001047 | Pa×s | 609.08 | Joback Calculated Property |
| η | 0.0000752 | Pa×s | 660.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-tert-Butoxypropan-2-yl nonanoate.
Sources
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