- InChI
- InChI=1S/C17H24O7/c1-4-5-6-10-23-15(18)11-22-12-16(19)24-17-13(20-2)8-7-9-14(17)21-3/h7-9H,4-6,10-12H2,1-3H3
- InChI Key
- VZJFYFHJXZRHCS-UHFFFAOYSA-N
- Formula
- C17H24O7
- SMILES
-
CCCCCOC(=O)COCC(=O)Oc1c(OC)ccc
c1OC - Molecular Weight1
- 340.37
- 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 | 1.0065 | Relay (1.0) Calculated Property | |
| ΔfG° | -597.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1123.58 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 42.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.05 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.90 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.359 | Crippen Calculated Property | |
| McVol | 259.120 | ml/mol | McGowan Calculated Property |
| Pc | 1589.81 | kPa | Joback Calculated Property |
| Inp | [2988.00; 2988.00] |
|
|
| Inp | 2988.00 | NIST | |
| Inp | 2988.00 | NIST | |
| Tboil | 646.00 | K | Relay (1.0) Calculated Property |
| Tc | 839.08 | K | Relay (1.0) Calculated Property |
| Tfus | 321.92 | K | Relay (1.0) Calculated Property |
| Vc | 0.961 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [788.17; 853.30] | J/mol×K | [844.84; 1046.96] |
|
| Cp,gas | 788.17 | J/mol×K | 844.84 | Joback Calculated Property |
| Cp,gas | 802.16 | J/mol×K | 878.53 | Joback Calculated Property |
| Cp,gas | 814.94 | J/mol×K | 912.21 | Joback Calculated Property |
| Cp,gas | 826.47 | J/mol×K | 945.90 | Joback Calculated Property |
| Cp,gas | 836.72 | J/mol×K | 979.59 | Joback Calculated Property |
| Cp,gas | 845.68 | J/mol×K | 1013.27 | Joback Calculated Property |
| Cp,gas | 853.30 | J/mol×K | 1046.96 | Joback Calculated Property |
| η | [0.0000358; 0.0002466] | Pa×s | [543.82; 844.84] |
|
| η | 0.0002466 | Pa×s | 543.82 | Joback Calculated Property |
| η | 0.0001561 | Pa×s | 593.99 | Joback Calculated Property |
| η | 0.0001061 | Pa×s | 644.16 | Joback Calculated Property |
| η | 0.0000762 | Pa×s | 694.33 | Joback Calculated Property |
| η | 0.0000573 | Pa×s | 744.50 | Joback Calculated Property |
| η | 0.0000446 | Pa×s | 794.67 | Joback Calculated Property |
| η | 0.0000358 | Pa×s | 844.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 2,6-dimethoxyphenyl pentyl ester.
Sources
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