- InChI
- InChI=1S/C27H48O4/c1-5-6-7-8-9-10-11-12-13-14-22-30-25(28)16-15-17-26(29)31-24-20-18-23(19-21-24)27(2,3)4/h13-14,23-24H,5-12,15-22H2,1-4H3/b14-13-
- InChI Key
- DNDDXYCKEPNEAX-YPKPFQOOSA-N
- Formula
- C27H48O4
- SMILES
-
CCCCCCCCCC=CCOC(=O)CCCC(=O)OC1
CCC(C(C)(C)C)CC1 - Molecular Weight1
- 436.67
- 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° | -191.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -947.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 56.95 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.79 | kJ/mol | Joback Calculated Property |
| log10WS | -8.23 | Crippen Calculated Property | |
| logPoct/wat | 7.545 | Crippen Calculated Property | |
| McVol | 391.010 | ml/mol | McGowan Calculated Property |
| Pc | 828.11 | kPa | Joback Calculated Property |
| Inp | [3013.00; 3013.00] |
|
|
| Inp | 3013.00 | NIST | |
| Inp | 3013.00 | NIST | |
| Tboil | 985.55 | K | Joback Calculated Property |
| Tc | 1206.67 | K | Joback Calculated Property |
| Tfus | 538.85 | K | Joback Calculated Property |
| Vc | 1.496 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1381.96; 1478.42] | J/mol×K | [985.55; 1206.67] |
|
| Cp,gas | 1381.96 | J/mol×K | 985.55 | Joback Calculated Property |
| Cp,gas | 1401.81 | J/mol×K | 1022.40 | Joback Calculated Property |
| Cp,gas | 1420.05 | J/mol×K | 1059.26 | Joback Calculated Property |
| Cp,gas | 1436.74 | J/mol×K | 1096.11 | Joback Calculated Property |
| Cp,gas | 1451.97 | J/mol×K | 1132.96 | Joback Calculated Property |
| Cp,gas | 1465.84 | J/mol×K | 1169.81 | Joback Calculated Property |
| Cp,gas | 1478.42 | J/mol×K | 1206.67 | Joback Calculated Property |
| η | [0.0000169; 0.0003739] | Pa×s | [538.85; 985.55] |
|
| η | 0.0003739 | Pa×s | 538.85 | Joback Calculated Property |
| η | 0.0001631 | Pa×s | 613.30 | Joback Calculated Property |
| η | 0.0000851 | Pa×s | 687.75 | Joback Calculated Property |
| η | 0.0000505 | Pa×s | 762.20 | Joback Calculated Property |
| η | 0.0000328 | Pa×s | 836.65 | Joback Calculated Property |
| η | 0.0000229 | Pa×s | 911.10 | Joback Calculated Property |
| η | 0.0000169 | Pa×s | 985.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, dodec-2-en-1-yl cis-4-tert-butylcyclohexyl ester.
Sources
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