- InChI
- InChI=1S/C25H47NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-29-24(27)22-26(2)25(28)23-19-20-23/h23H,3-22H2,1-2H3
- InChI Key
- PXNGDCKHOLPSCR-UHFFFAOYSA-N
- Formula
- C25H47NO3
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)CN(C)C
(=O)C1CC1 - Molecular Weight1
- 409.65
- 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).
- 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 | 1.1638 | Relay (1.0) Calculated Property | |
| ΔfG° | -31.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -886.12 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 66.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 125.53 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.88 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.43 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.659 | Crippen Calculated Property | |
| McVol | 371.240 | ml/mol | McGowan Calculated Property |
| Pc | 874.80 | kPa | Joback Calculated Property |
| Tboil | 649.33 | K | Relay (1.0) Calculated Property |
| Tc | 868.44 | K | Relay (1.0) Calculated Property |
| Tfus | 329.13 | K | Relay (1.0) Calculated Property |
| Vc | 1.438 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1277.19; 1386.16] | J/mol×K | [920.74; 1128.31] | 
|
| Cp,gas | 1277.19 | J/mol×K | 920.74 | Joback Calculated Property |
| Cp,gas | 1298.16 | J/mol×K | 955.34 | Joback Calculated Property |
| Cp,gas | 1317.89 | J/mol×K | 989.93 | Joback Calculated Property |
| Cp,gas | 1336.46 | J/mol×K | 1024.53 | Joback Calculated Property |
| Cp,gas | 1353.97 | J/mol×K | 1059.12 | Joback Calculated Property |
| Cp,gas | 1370.51 | J/mol×K | 1093.72 | Joback Calculated Property |
| Cp,gas | 1386.16 | J/mol×K | 1128.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-cyclopropylcarbonyl-, octadecyl ester.
Sources
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