- InChI
- InChI=1S/C14H25ClO4/c1-2-18-13(16)9-10-14(17)19-12-8-6-4-3-5-7-11-15/h2-12H2,1H3
- InChI Key
- SJXVGPNAVQCMJO-UHFFFAOYSA-N
- Formula
- C14H25ClO4
- SMILES
- CCOC(=O)CCC(=O)OCCCCCCCCCl
- Molecular Weight1
- 292.80
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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 | 0.8571 | Relay (1.0) Calculated Property | |
| ΔfG° | -565.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -979.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 44.95 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.31 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.77 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.08 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.452 | Crippen Calculated Property | |
| McVol | 235.240 | ml/mol | McGowan Calculated Property |
| Pc | 1491.89 | kPa | Joback Calculated Property |
| Inp | [2062.00; 2062.00] |
|
|
| Inp | 2062.00 | NIST | |
| Inp | 2062.00 | NIST | |
| Tboil | 581.48 | K | Relay (1.0) Calculated Property |
| Tc | 767.90 | K | Relay (1.0) Calculated Property |
| Tfus | 275.22 | K | Relay (1.0) Calculated Property |
| Vc | 0.896 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [348.55; 766.09] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 5.38710e+01 | |||
| Coefficient B | 1.23102e+00 | |||
| Coefficient C | -5.69000e-04 | |||
| Coefficient D | 5.02000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 348.55 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 420.39 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 485.49 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 544.02 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 596.14 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 642.00 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 681.77 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 715.60 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 743.66 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 766.09 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0023500; 0.0001450] | Pa×s | [362.12; 594.66] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.31765e+01 | |||
| Coefficient B | 2.57944e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 362.12 | |||
| Temperature range, max. | 594.66 | |||
| η | 0.0023500 | Pa×s | 362.12 | Calculated Property |
| η | 0.0014623 | Pa×s | 387.96 | Calculated Property |
| η | 0.0009655 | Pa×s | 413.79 | Calculated Property |
| η | 0.0006693 | Pa×s | 439.63 | Calculated Property |
| η | 0.0004833 | Pa×s | 465.47 | Calculated Property |
| η | 0.0003611 | Pa×s | 491.31 | Calculated Property |
| η | 0.0002778 | Pa×s | 517.14 | Calculated Property |
| η | 0.0002191 | Pa×s | 542.98 | Calculated Property |
| η | 0.0001766 | Pa×s | 568.82 | Calculated Property |
| η | 0.0001450 | Pa×s | 594.66 | Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 8-chloroctyl ethyl ester.
Sources
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