- InChI
- InChI=1S/C22H38F5NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-31-19(29)18-28(2)20(30)21(23,24)22(25,26)27/h3-18H2,1-2H3
- InChI Key
- GSGCQKPYPJZCRY-UHFFFAOYSA-N
- Formula
- C22H38F5NO3
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)CN(C)C(=
O)C(F)(F)C(F)(F)F - Molecular Weight1
- 459.53
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 1.0771 | Relay (1.0) Calculated Property | |
| ΔfG° | -1086.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1925.30 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 60.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.34 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.667 | Crippen Calculated Property | |
| McVol | 348.680 | ml/mol | McGowan Calculated Property |
| Pc | 859.99 | kPa | Joback Calculated Property |
| Inp | 2422.00 | NIST | |
| Tboil | 604.66 | K | Relay (1.0) Calculated Property |
| Tc | 740.28 | K | Relay (1.0) Calculated Property |
| Tfus | 295.16 | K | Relay (1.0) Calculated Property |
| Vc | 1.318 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1141.34; 1237.40] | J/mol×K | [835.25; 1023.47] | 
|
| Cp,gas | 1141.34 | J/mol×K | 835.25 | Joback Calculated Property |
| Cp,gas | 1159.86 | J/mol×K | 866.62 | Joback Calculated Property |
| Cp,gas | 1177.27 | J/mol×K | 897.99 | Joback Calculated Property |
| Cp,gas | 1193.66 | J/mol×K | 929.36 | Joback Calculated Property |
| Cp,gas | 1209.10 | J/mol×K | 960.73 | Joback Calculated Property |
| Cp,gas | 1223.65 | J/mol×K | 992.10 | Joback Calculated Property |
| Cp,gas | 1237.40 | J/mol×K | 1023.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, n-pentafluoropropionyl-, hexadecyl ester.
Sources
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