- InChI
- InChI=1S/C19H33ClO4/c1-2-3-4-8-11-16-23-18(21)13-14-19(22)24-17-12-9-6-5-7-10-15-20/h13-14H,2-12,15-17H2,1H3/b14-13+
- InChI Key
- FBIIAROAPWHMQC-BUHFOSPRSA-N
- Formula
- C19H33ClO4
- SMILES
-
CCCCCCCOC(=O)C=CC(=O)OCCCCCCCC
Cl - Molecular Weight1
- 360.92
- 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 | 1.0295 | Relay (1.0) Calculated Property | |
| ΔfG° | -290.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -981.18 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 54.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.13 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.15 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.179 | Crippen Calculated Property | |
| McVol | 301.390 | ml/mol | McGowan Calculated Property |
| Pc | 1160.87 | kPa | Joback Calculated Property |
| Inp | [2608.00; 2608.00] |
|
|
| Inp | 2608.00 | NIST | |
| Inp | 2608.00 | NIST | |
| Tboil | 614.70 | K | Relay (1.0) Calculated Property |
| Tc | 804.64 | K | Relay (1.0) Calculated Property |
| Tfus | 300.01 | K | Relay (1.0) Calculated Property |
| Vc | 1.123 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [914.69; 998.98] | J/mol×K | [828.29; 1018.24] |
|
| Cp,gas | 914.69 | J/mol×K | 828.29 | Joback Calculated Property |
| Cp,gas | 931.08 | J/mol×K | 859.95 | Joback Calculated Property |
| Cp,gas | 946.49 | J/mol×K | 891.61 | Joback Calculated Property |
| Cp,gas | 960.96 | J/mol×K | 923.26 | Joback Calculated Property |
| Cp,gas | 974.51 | J/mol×K | 954.92 | Joback Calculated Property |
| Cp,gas | 987.18 | J/mol×K | 986.58 | Joback Calculated Property |
| Cp,gas | 998.98 | J/mol×K | 1018.24 | Joback Calculated Property |
| η | [0.0000460; 0.0006884] | Pa×s | [473.05; 828.29] |
|
| η | 0.0006884 | Pa×s | 473.05 | Joback Calculated Property |
| η | 0.0003413 | Pa×s | 532.26 | Joback Calculated Property |
| η | 0.0001947 | Pa×s | 591.46 | Joback Calculated Property |
| η | 0.0001231 | Pa×s | 650.67 | Joback Calculated Property |
| η | 0.0000839 | Pa×s | 709.88 | Joback Calculated Property |
| η | 0.0000607 | Pa×s | 769.08 | Joback Calculated Property |
| η | 0.0000460 | Pa×s | 828.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 8-chlorooctyl heptyl ester.
Sources
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