- InChI
- InChI=1S/C19H29NO4/c1-3-4-5-6-7-8-14-24-18(21)12-13-20-19(22)16-10-9-11-17(15-16)23-2/h9-11,15H,3-8,12-14H2,1-2H3,(H,20,22)
- InChI Key
- HEVAFTFLJRNSHF-UHFFFAOYSA-N
- Formula
- C19H29NO4
- SMILES
-
CCCCCCCCOC(=O)CCNC(=O)c1cccc(O
C)c1 - Molecular Weight1
- 335.44
- 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 | 1.0054 | Relay (1.0) Calculated Property | |
| ΔfG° | -166.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -751.32 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 49.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.43 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.60 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.719 | Crippen Calculated Property | |
| McVol | 279.670 | ml/mol | McGowan Calculated Property |
| Pc | 1455.68 | kPa | Joback Calculated Property |
| Inp | 2757.00 | NIST | |
| Tboil | 661.24 | K | Relay (1.0) Calculated Property |
| Tc | 879.93 | K | Relay (1.0) Calculated Property |
| Tfus | 319.00 | K | Relay (1.0) Calculated Property |
| Vc | 1.028 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [877.84; 951.64] | J/mol×K | [868.53; 1072.52] | 
|
| Cp,gas | 877.84 | J/mol×K | 868.53 | Joback Calculated Property |
| Cp,gas | 892.93 | J/mol×K | 902.53 | Joback Calculated Property |
| Cp,gas | 906.88 | J/mol×K | 936.53 | Joback Calculated Property |
| Cp,gas | 919.70 | J/mol×K | 970.53 | Joback Calculated Property |
| Cp,gas | 931.42 | J/mol×K | 1004.53 | Joback Calculated Property |
| Cp,gas | 942.05 | J/mol×K | 1038.52 | Joback Calculated Property |
| Cp,gas | 951.64 | J/mol×K | 1072.52 | Joback Calculated Property |
Similar Compounds
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Sources
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