- InChI
- InChI=1S/C18H26N2O5/c1-3-4-5-6-7-8-13-25-17(21)14-19(2)18(22)15-9-11-16(12-10-15)20(23)24/h9-12H,3-8,13-14H2,1-2H3
- InChI Key
- QEURJEZPYYPEEO-UHFFFAOYSA-N
- Formula
- C18H26N2O5
- SMILES
-
CCCCCCCCOC(=O)CN(C)C(=O)c1ccc(
[N+](=O)[O-])cc1 - Molecular Weight1
- 350.41
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -13.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -490.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.80 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.14 | kJ/mol | Joback Calculated Property |
| log10WS | -4.90 | Crippen Calculated Property | |
| logPoct/wat | 3.571 | Crippen Calculated Property | |
| McVol | 277.130 | ml/mol | McGowan Calculated Property |
| Pc | 1586.01 | kPa | Joback Calculated Property |
| Inp | 2853.00 | NIST | |
| Tboil | 937.34 | K | Joback Calculated Property |
| Tc | 1158.63 | K | Joback Calculated Property |
| Tfus | 629.73 | K | Joback Calculated Property |
| Vc | 1.065 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [885.60; 948.52] | J/mol×K | [937.34; 1158.63] | 
|
| Cp,gas | 885.60 | J/mol×K | 937.34 | Joback Calculated Property |
| Cp,gas | 898.71 | J/mol×K | 974.22 | Joback Calculated Property |
| Cp,gas | 910.69 | J/mol×K | 1011.10 | Joback Calculated Property |
| Cp,gas | 921.61 | J/mol×K | 1047.98 | Joback Calculated Property |
| Cp,gas | 931.51 | J/mol×K | 1084.86 | Joback Calculated Property |
| Cp,gas | 940.46 | J/mol×K | 1121.75 | Joback Calculated Property |
| Cp,gas | 948.52 | J/mol×K | 1158.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(4-nitrobenzoyl)-, octyl ester.
Sources
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