- InChI
- InChI=1S/C27H52O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23-30-26(28)21-22-27(29)31-25(4)20-18-19-24(2)3/h24-25H,5-23H2,1-4H3
- InChI Key
- AYOCPNHLYOHQGW-UHFFFAOYSA-N
- Formula
- C27H52O4
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)CCC(=O)OC
(C)CCCC(C)C - Molecular Weight1
- 440.71
- 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 | 1.2090 | Relay (1.0) Calculated Property | |
| ΔfG° | -449.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1236.12 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 67.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 122.59 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.82 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.45 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.159 | Crippen Calculated Property | |
| McVol | 406.170 | ml/mol | McGowan Calculated Property |
| Pc | 698.39 | kPa | Joback Calculated Property |
| Inp | [2902.00; 2902.00] |
|
|
| Inp | 2902.00 | NIST | |
| Inp | 2902.00 | NIST | |
| Tboil | 649.11 | K | Relay (1.0) Calculated Property |
| Tc | 828.23 | K | Relay (1.0) Calculated Property |
| Tfus | 287.75 | K | Relay (1.0) Calculated Property |
| Vc | 1.559 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1390.83; 1493.86] | J/mol×K | [932.92; 1147.56] |
|
| Cp,gas | 1390.83 | J/mol×K | 932.92 | Joback Calculated Property |
| Cp,gas | 1412.27 | J/mol×K | 968.69 | Joback Calculated Property |
| Cp,gas | 1431.94 | J/mol×K | 1004.47 | Joback Calculated Property |
| Cp,gas | 1449.88 | J/mol×K | 1040.24 | Joback Calculated Property |
| Cp,gas | 1466.14 | J/mol×K | 1076.01 | Joback Calculated Property |
| Cp,gas | 1480.79 | J/mol×K | 1111.78 | Joback Calculated Property |
| Cp,gas | 1493.86 | J/mol×K | 1147.56 | Joback Calculated Property |
| η | [0.0000117; 0.0008543] | Pa×s | [448.71; 932.92] |
|
| η | 0.0008543 | Pa×s | 448.71 | Joback Calculated Property |
| η | 0.0002424 | Pa×s | 529.41 | Joback Calculated Property |
| η | 0.0000960 | Pa×s | 610.11 | Joback Calculated Property |
| η | 0.0000472 | Pa×s | 690.82 | Joback Calculated Property |
| η | 0.0000269 | Pa×s | 771.52 | Joback Calculated Property |
| η | 0.0000171 | Pa×s | 852.22 | Joback Calculated Property |
| η | 0.0000117 | Pa×s | 932.92 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 6-methylhept-2-yl pentadecyl ester.
Sources
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