- InChI
- InChI=1S/C16H19ClO4/c1-11(2)8-9-20-15(18)6-7-16(19)21-13-4-5-14(17)12(3)10-13/h4-5,10H,1,6-9H2,2-3H3
- InChI Key
- VXHQNUYSKWQYQF-UHFFFAOYSA-N
- Formula
- C16H19ClO4
- SMILES
-
C=C(C)CCOC(=O)CCC(=O)Oc1ccc(Cl
)c(C)c1 - Molecular Weight1
- 310.77
- 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° | -223.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -549.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.92 | kJ/mol | Joback Calculated Property |
| log10WS | -4.59 | Crippen Calculated Property | |
| logPoct/wat | 3.843 | Crippen Calculated Property | |
| McVol | 235.360 | ml/mol | McGowan Calculated Property |
| Pc | 1809.23 | kPa | Joback Calculated Property |
| Inp | [2254.00; 2254.00] |
|
|
| Inp | 2254.00 | NIST | |
| Inp | 2254.00 | NIST | |
| Tboil | 788.69 | K | Joback Calculated Property |
| Tc | 1000.18 | K | Joback Calculated Property |
| Tfus | 480.06 | K | Joback Calculated Property |
| Vc | 0.902 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [647.93; 714.75] | J/mol×K | [788.69; 1000.18] |
|
| Cp,gas | 647.93 | J/mol×K | 788.69 | Joback Calculated Property |
| Cp,gas | 661.46 | J/mol×K | 823.94 | Joback Calculated Property |
| Cp,gas | 674.01 | J/mol×K | 859.19 | Joback Calculated Property |
| Cp,gas | 685.60 | J/mol×K | 894.43 | Joback Calculated Property |
| Cp,gas | 696.25 | J/mol×K | 929.68 | Joback Calculated Property |
| Cp,gas | 705.95 | J/mol×K | 964.93 | Joback Calculated Property |
| Cp,gas | 714.75 | J/mol×K | 1000.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 4-chloro-3-methylphenyl 3-methylbut-3-en-1-yl ester.
Sources
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