- InChI
- InChI=1S/C17H32O5/c1-5-7-8-9-10-11-21-16(18)12-20-13-17(19)22-15(4)14(3)6-2/h14-15H,5-13H2,1-4H3
- InChI Key
- ZMIHCUFBOPDSGG-UHFFFAOYSA-N
- Formula
- C17H32O5
- SMILES
-
CCCCCCCOC(=O)COCC(=O)OC(C)C(C)
CC - Molecular Weight1
- 316.43
- 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° | -485.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1026.59 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.38 | kJ/mol | Joback Calculated Property |
| log10WS | -3.62 | Crippen Calculated Property | |
| logPoct/wat | 3.494 | Crippen Calculated Property | |
| McVol | 271.140 | ml/mol | McGowan Calculated Property |
| Pc | 1313.70 | kPa | Joback Calculated Property |
| Inp | [2533.00; 2533.00] |
|
|
| Inp | 2533.00 | NIST | |
| Inp | 2533.00 | NIST | |
| Tboil | 762.48 | K | Joback Calculated Property |
| Tc | 944.32 | K | Joback Calculated Property |
| Tfus | 417.90 | K | Joback Calculated Property |
| Vc | 1.042 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [822.56; 910.80] | J/mol×K | [762.48; 944.32] |
|
| Cp,gas | 822.56 | J/mol×K | 762.48 | Joback Calculated Property |
| Cp,gas | 839.65 | J/mol×K | 792.79 | Joback Calculated Property |
| Cp,gas | 855.78 | J/mol×K | 823.09 | Joback Calculated Property |
| Cp,gas | 870.96 | J/mol×K | 853.40 | Joback Calculated Property |
| Cp,gas | 885.19 | J/mol×K | 883.71 | Joback Calculated Property |
| Cp,gas | 898.47 | J/mol×K | 914.02 | Joback Calculated Property |
| Cp,gas | 910.80 | J/mol×K | 944.32 | Joback Calculated Property |
| η | [0.0000520; 0.0011284] | Pa×s | [417.90; 762.48] |
|
| η | 0.0011284 | Pa×s | 417.90 | Joback Calculated Property |
| η | 0.0004957 | Pa×s | 475.33 | Joback Calculated Property |
| η | 0.0002600 | Pa×s | 532.76 | Joback Calculated Property |
| η | 0.0001546 | Pa×s | 590.19 | Joback Calculated Property |
| η | 0.0001008 | Pa×s | 647.62 | Joback Calculated Property |
| η | 0.0000705 | Pa×s | 705.05 | Joback Calculated Property |
| η | 0.0000520 | Pa×s | 762.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, heptyl 3-methylpent-2-yl ester.
Sources
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