- InChI
- InChI=1S/C25H46O4/c1-3-5-7-8-9-12-15-19-23-29-25(27)21-17-14-11-10-13-16-20-24(26)28-22-18-6-4-2/h4H,2-3,5-23H2,1H3
- InChI Key
- UPWVWNUVGRUUKO-UHFFFAOYSA-N
- Formula
- C25H46O4
- SMILES
-
C=CCCCOC(=O)CCCCCCCCC(=O)OCCCC
CCCCCC - Molecular Weight1
- 410.63
- 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 | 1.1795 | Relay (1.0) Calculated Property | |
| ΔfG° | -373.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1073.12 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 67.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 117.10 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.49 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.49 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.300 | Crippen Calculated Property | |
| McVol | 373.690 | ml/mol | McGowan Calculated Property |
| Pc | 786.39 | kPa | Joback Calculated Property |
| Inp | [2881.00; 2881.00] |
|
|
| Inp | 2881.00 | NIST | |
| Inp | 2881.00 | NIST | |
| Tboil | 670.80 | K | Relay (1.0) Calculated Property |
| Tc | 827.39 | K | Relay (1.0) Calculated Property |
| Tfus | 291.64 | K | Relay (1.0) Calculated Property |
| Vc | 1.426 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1233.43; 1332.95] | J/mol×K | [884.72; 1084.34] |
|
| Cp,gas | 1233.43 | J/mol×K | 884.72 | Joback Calculated Property |
| Cp,gas | 1253.47 | J/mol×K | 917.99 | Joback Calculated Property |
| Cp,gas | 1272.07 | J/mol×K | 951.26 | Joback Calculated Property |
| Cp,gas | 1289.27 | J/mol×K | 984.53 | Joback Calculated Property |
| Cp,gas | 1305.13 | J/mol×K | 1017.80 | Joback Calculated Property |
| Cp,gas | 1319.67 | J/mol×K | 1051.07 | Joback Calculated Property |
| Cp,gas | 1332.95 | J/mol×K | 1084.34 | Joback Calculated Property |
| η | [0.0000209; 0.0007764] | Pa×s | [454.41; 884.72] |
|
| η | 0.0007764 | Pa×s | 454.41 | Joback Calculated Property |
| η | 0.0002818 | Pa×s | 526.13 | Joback Calculated Property |
| η | 0.0001304 | Pa×s | 597.85 | Joback Calculated Property |
| η | 0.0000712 | Pa×s | 669.57 | Joback Calculated Property |
| η | 0.0000437 | Pa×s | 741.28 | Joback Calculated Property |
| η | 0.0000292 | Pa×s | 813.00 | Joback Calculated Property |
| η | 0.0000209 | Pa×s | 884.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, decyl pent-4-enyl ester.
Sources
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