- InChI
- InChI=1S/C19H28O7/c1-4-5-6-7-8-12-25-17(20)13-24-14-18(21)26-19-15(22-2)10-9-11-16(19)23-3/h9-11H,4-8,12-14H2,1-3H3
- InChI Key
- OBXRDTPVPHLBDH-UHFFFAOYSA-N
- Formula
- C19H28O7
- SMILES
-
CCCCCCCOC(=O)COCC(=O)Oc1c(OC)c
ccc1OC - Molecular Weight1
- 368.42
- 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 | 1.0839 | Relay (1.0) Calculated Property | |
| ΔfG° | -580.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1161.81 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 47.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.51 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.07 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.139 | Crippen Calculated Property | |
| McVol | 287.300 | ml/mol | McGowan Calculated Property |
| Pc | 1371.74 | kPa | Joback Calculated Property |
| Inp | 3228.00 | NIST | |
| Tboil | 660.88 | K | Relay (1.0) Calculated Property |
| Tc | 855.05 | K | Relay (1.0) Calculated Property |
| Tfus | 323.75 | K | Relay (1.0) Calculated Property |
| Vc | 1.070 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [904.79; 968.91] | J/mol×K | [890.60; 1095.42] | 
|
| Cp,gas | 904.79 | J/mol×K | 890.60 | Joback Calculated Property |
| Cp,gas | 919.03 | J/mol×K | 924.74 | Joback Calculated Property |
| Cp,gas | 931.88 | J/mol×K | 958.87 | Joback Calculated Property |
| Cp,gas | 943.32 | J/mol×K | 993.01 | Joback Calculated Property |
| Cp,gas | 953.32 | J/mol×K | 1027.14 | Joback Calculated Property |
| Cp,gas | 961.86 | J/mol×K | 1061.28 | Joback Calculated Property |
| Cp,gas | 968.91 | J/mol×K | 1095.42 | Joback Calculated Property |
| η | [0.0000269; 0.0002015] | Pa×s | [566.36; 890.60] |
|
| η | 0.0002015 | Pa×s | 566.36 | Joback Calculated Property |
| η | 0.0001245 | Pa×s | 620.40 | Joback Calculated Property |
| η | 0.0000830 | Pa×s | 674.44 | Joback Calculated Property |
| η | 0.0000588 | Pa×s | 728.48 | Joback Calculated Property |
| η | 0.0000437 | Pa×s | 782.52 | Joback Calculated Property |
| η | 0.0000338 | Pa×s | 836.56 | Joback Calculated Property |
| η | 0.0000269 | Pa×s | 890.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 2,6-dimethoxyphenyl heptyl ester.
Sources
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