- InChI
- InChI=1S/C16H24Cl2O4/c1-12(2)5-4-6-13(3)9-10-21-15(19)7-8-16(20)22-11-14(17)18/h5,9,14H,4,6-8,10-11H2,1-3H3/b13-9-
- InChI Key
- OLLMSDFYNCTPLD-LCYFTJDESA-N
- Formula
- C16H24Cl2O4
- SMILES
-
CC(C)=CCCC(C)=CCOC(=O)CCC(=O)O
CC(Cl)Cl - Molecular Weight1
- 351.26
- 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° | -266.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -685.07 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.98 | kJ/mol | Joback Calculated Property |
| log10WS | -4.87 | Crippen Calculated Property | |
| logPoct/wat | 4.349 | Crippen Calculated Property | |
| McVol | 267.060 | ml/mol | McGowan Calculated Property |
| Pc | 1463.49 | kPa | Joback Calculated Property |
| Inp | [2255.00; 2255.00] |
|
|
| Inp | 2255.00 | NIST | |
| Inp | 2255.00 | NIST | |
| Tboil | 800.56 | K | Joback Calculated Property |
| Tc | 1001.01 | K | Joback Calculated Property |
| Tfus | 421.16 | K | Joback Calculated Property |
| Vc | 1.034 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [742.81; 815.50] | J/mol×K | [800.56; 1001.01] |
|
| Cp,gas | 742.81 | J/mol×K | 800.56 | Joback Calculated Property |
| Cp,gas | 756.95 | J/mol×K | 833.97 | Joback Calculated Property |
| Cp,gas | 770.22 | J/mol×K | 867.38 | Joback Calculated Property |
| Cp,gas | 782.68 | J/mol×K | 900.79 | Joback Calculated Property |
| Cp,gas | 794.35 | J/mol×K | 934.20 | Joback Calculated Property |
| Cp,gas | 805.28 | J/mol×K | 967.60 | Joback Calculated Property |
| Cp,gas | 815.50 | J/mol×K | 1001.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2,2-dichloroethyl neryl ester.
Sources
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