- InChI
- InChI=1S/C17H21ClO4/c1-3-4-5-6-11-21-16(19)9-10-17(20)22-14-7-8-15(18)13(2)12-14/h3,7-8,12H,1,4-6,9-11H2,2H3
- InChI Key
- UPDFPDFCLIGDGL-UHFFFAOYSA-N
- Formula
- C17H21ClO4
- SMILES
-
C=CCCCCOC(=O)CCC(=O)Oc1ccc(Cl)
c(C)c1 - Molecular Weight1
- 324.80
- 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).
- 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° | -206.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -560.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.06 | kJ/mol | Joback Calculated Property |
| log10WS | -5.01 | Crippen Calculated Property | |
| logPoct/wat | 4.234 | Crippen Calculated Property | |
| McVol | 249.450 | ml/mol | McGowan Calculated Property |
| Pc | 1663.26 | kPa | Joback Calculated Property |
| Inp | [2420.00; 2420.00] |
|
|
| Inp | 2420.00 | NIST | |
| Inp | 2420.00 | NIST | |
| Tboil | 811.69 | K | Joback Calculated Property |
| Tc | 1019.33 | K | Joback Calculated Property |
| Tfus | 505.29 | K | Joback Calculated Property |
| Vc | 0.958 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [703.91; 771.41] | J/mol×K | [811.69; 1019.33] |
|
| Cp,gas | 703.91 | J/mol×K | 811.69 | Joback Calculated Property |
| Cp,gas | 717.59 | J/mol×K | 846.30 | Joback Calculated Property |
| Cp,gas | 730.28 | J/mol×K | 880.90 | Joback Calculated Property |
| Cp,gas | 741.99 | J/mol×K | 915.51 | Joback Calculated Property |
| Cp,gas | 752.74 | J/mol×K | 950.11 | Joback Calculated Property |
| Cp,gas | 762.54 | J/mol×K | 984.72 | Joback Calculated Property |
| Cp,gas | 771.41 | J/mol×K | 1019.33 | Joback Calculated Property |
| η | [0.0000778; 0.0005783] | Pa×s | [505.29; 811.69] |
|
| η | 0.0005783 | Pa×s | 505.29 | Joback Calculated Property |
| η | 0.0003551 | Pa×s | 556.36 | Joback Calculated Property |
| η | 0.0002367 | Pa×s | 607.42 | Joback Calculated Property |
| η | 0.0001680 | Pa×s | 658.49 | Joback Calculated Property |
| η | 0.0001253 | Pa×s | 709.56 | Joback Calculated Property |
| η | 0.0000972 | Pa×s | 760.62 | Joback Calculated Property |
| η | 0.0000778 | Pa×s | 811.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 4-chloro-3-methylphenyl hex-5-en-1-yl ester.
Sources
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