- InChI
- InChI=1S/C22H34O5/c1-2-3-4-5-6-7-11-16-26-21(23)18-25-19-22(24)27-17-12-15-20-13-9-8-10-14-20/h8-10,13-14H,2-7,11-12,15-19H2,1H3
- InChI Key
- RIZBDRJTHAZVMB-UHFFFAOYSA-N
- Formula
- C22H34O5
- SMILES
-
CCCCCCCCCOC(=O)COCC(=O)OCCCc1c
cccc1 - Molecular Weight1
- 378.50
- 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 | 1.0801 | Relay (1.0) Calculated Property | |
| ΔfG° | -326.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -979.87 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 53.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 113.08 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.63 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.04 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.473 | Crippen Calculated Property | |
| McVol | 317.830 | ml/mol | McGowan Calculated Property |
| Pc | 1169.62 | kPa | Joback Calculated Property |
| Inp | [3500.00; 3500.00] |
|
|
| Inp | 3500.00 | NIST | |
| Inp | 3500.00 | NIST | |
| Tboil | 677.52 | K | Relay (1.0) Calculated Property |
| Tc | 857.82 | K | Relay (1.0) Calculated Property |
| Tfus | 294.90 | K | Relay (1.0) Calculated Property |
| Vc | 1.193 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1027.65; 1104.75] | J/mol×K | [904.44; 1109.57] |
|
| Cp,gas | 1027.65 | J/mol×K | 904.44 | Joback Calculated Property |
| Cp,gas | 1043.76 | J/mol×K | 938.63 | Joback Calculated Property |
| Cp,gas | 1058.53 | J/mol×K | 972.82 | Joback Calculated Property |
| Cp,gas | 1072.00 | J/mol×K | 1007.01 | Joback Calculated Property |
| Cp,gas | 1084.17 | J/mol×K | 1041.19 | Joback Calculated Property |
| Cp,gas | 1095.08 | J/mol×K | 1075.38 | Joback Calculated Property |
| Cp,gas | 1104.75 | J/mol×K | 1109.57 | Joback Calculated Property |
| η | [0.0000302; 0.0003866] | Pa×s | [530.67; 904.44] |
|
| η | 0.0003866 | Pa×s | 530.67 | Joback Calculated Property |
| η | 0.0002022 | Pa×s | 592.96 | Joback Calculated Property |
| η | 0.0001196 | Pa×s | 655.26 | Joback Calculated Property |
| η | 0.0000775 | Pa×s | 717.55 | Joback Calculated Property |
| η | 0.0000538 | Pa×s | 779.85 | Joback Calculated Property |
| η | 0.0000395 | Pa×s | 842.14 | Joback Calculated Property |
| η | 0.0000302 | Pa×s | 904.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, nonyl 3-phenylpropyl ester.
Sources
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