- InChI
- InChI=1S/C9H17NO4/c1-4-5-6-14-8(11)7-10(2)9(12)13-3/h4-7H2,1-3H3
- InChI Key
- JTNWHBZXMUFBTK-UHFFFAOYSA-N
- Formula
- C9H17NO4
- SMILES
- CCCCOC(=O)CN(C)C(=O)OC
- Molecular Weight1
- 203.24
- 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° | -332.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -651.16 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.98 | kJ/mol | Joback Calculated Property |
| log10WS | -0.86 | Crippen Calculated Property | |
| logPoct/wat | 1.028 | Crippen Calculated Property | |
| McVol | 162.530 | ml/mol | McGowan Calculated Property |
| Pc | 2520.12 | kPa | Joback Calculated Property |
| Inp | 1396.00 | NIST | |
| Tboil | 570.34 | K | Joback Calculated Property |
| Tc | 750.33 | K | Joback Calculated Property |
| Tfus | 367.98 | K | Joback Calculated Property |
| Vc | 0.606 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [403.49; 473.05] | J/mol×K | [570.34; 750.33] | 
|
| Cp,gas | 403.49 | J/mol×K | 570.34 | Joback Calculated Property |
| Cp,gas | 416.47 | J/mol×K | 600.34 | Joback Calculated Property |
| Cp,gas | 428.89 | J/mol×K | 630.34 | Joback Calculated Property |
| Cp,gas | 440.76 | J/mol×K | 660.34 | Joback Calculated Property |
| Cp,gas | 452.08 | J/mol×K | 690.34 | Joback Calculated Property |
| Cp,gas | 462.84 | J/mol×K | 720.34 | Joback Calculated Property |
| Cp,gas | 473.05 | J/mol×K | 750.33 | Joback Calculated Property |
Similar Compounds
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Sources
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