- InChI
- InChI=1S/C18H26O6/c1-4-5-8-11-22-17(19)12-21-13-18(20)24-16-10-7-6-9-15(16)23-14(2)3/h6-7,9-10,14H,4-5,8,11-13H2,1-3H3
- InChI Key
- SSFKSUPWOHGHLB-UHFFFAOYSA-N
- Formula
- C18H26O6
- SMILES
-
CCCCCOC(=O)COCC(=O)Oc1ccccc1OC
(C)C - Molecular Weight1
- 338.40
- 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° | -476.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -949.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.34 | kJ/mol | Joback Calculated Property |
| log10WS | -3.73 | Crippen Calculated Property | |
| logPoct/wat | 3.129 | Crippen Calculated Property | |
| McVol | 267.340 | ml/mol | McGowan Calculated Property |
| Pc | 1521.12 | kPa | Joback Calculated Property |
| Inp | [2992.00; 2992.00] |
|
|
| Inp | 2992.00 | NIST | |
| Inp | 2992.00 | NIST | |
| Tboil | 839.88 | K | Joback Calculated Property |
| Tc | 1042.54 | K | Joback Calculated Property |
| Tfus | 505.34 | K | Joback Calculated Property |
| Vc | 1.014 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [819.17; 890.21] | J/mol×K | [839.88; 1042.54] |
|
| Cp,gas | 819.17 | J/mol×K | 839.88 | Joback Calculated Property |
| Cp,gas | 834.06 | J/mol×K | 873.66 | Joback Calculated Property |
| Cp,gas | 847.75 | J/mol×K | 907.43 | Joback Calculated Property |
| Cp,gas | 860.21 | J/mol×K | 941.21 | Joback Calculated Property |
| Cp,gas | 871.45 | J/mol×K | 974.98 | Joback Calculated Property |
| Cp,gas | 881.45 | J/mol×K | 1008.76 | Joback Calculated Property |
| Cp,gas | 890.21 | J/mol×K | 1042.54 | Joback Calculated Property |
| η | [0.0000375; 0.0004011] | Pa×s | [505.34; 839.88] |
|
| η | 0.0004011 | Pa×s | 505.34 | Joback Calculated Property |
| η | 0.0002221 | Pa×s | 561.10 | Joback Calculated Property |
| η | 0.0001369 | Pa×s | 616.85 | Joback Calculated Property |
| η | 0.0000914 | Pa×s | 672.61 | Joback Calculated Property |
| η | 0.0000649 | Pa×s | 728.37 | Joback Calculated Property |
| η | 0.0000484 | Pa×s | 784.12 | Joback Calculated Property |
| η | 0.0000375 | Pa×s | 839.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 2-isopropoxyphenyl pentyl ester.
Sources
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