- InChI
- InChI=1S/C25H46O4/c1-3-5-7-9-10-11-12-13-14-15-19-23-29-25(27)21-17-16-20-24(26)28-22-18-8-6-4-2/h6,8H,3-5,7,9-23H2,1-2H3/b8-6-
- InChI Key
- ORDSDMDWUAZDNZ-VURMDHGXSA-N
- Formula
- C25H46O4
- SMILES
-
CCC=CCCOC(=O)CCCCC(=O)OCCCCCCC
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 | 1.1391 | Relay (... Calculated Property | |
| ΔfG° | -228.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1098.35 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 66.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 116.67 | kJ/mol | Relay (... Calculated Property |
| IE | 9.07 | eV | Relay (... Calculated Property |
| log10WS | -6.46 | Relay (... Calculated Property | |
| logPoct/wat | 7.300 | Crippen Calculated Property | |
| McVol | 373.690 | ml/mol | McGowan Calculated Property |
| Pc | 828.59 | kPa | Joback Calculated Property |
| Inp | [2837.00; 2837.00] |
|
|
| Inp | 2837.00 | NIST | |
| Inp | 2837.00 | NIST | |
| Tboil | 648.63 | K | Relay (... Calculated Property |
| Tc | 820.74 | K | Relay (... Calculated Property |
| Tfus | 271.44 | K | Relay (... Calculated Property |
| Vc | 1.418 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1253.80; 1354.81] | J/mol×K | [928.14; 1138.56] |
|
| Cp,gas | 1253.80 | J/mol×K | 928.14 | Joback Calculated Property |
| Cp,gas | 1273.93 | J/mol×K | 963.21 | Joback Calculated Property |
| Cp,gas | 1292.67 | J/mol×K | 998.28 | Joback Calculated Property |
| Cp,gas | 1310.08 | J/mol×K | 1033.35 | Joback Calculated Property |
| Cp,gas | 1326.20 | J/mol×K | 1068.42 | Joback Calculated Property |
| Cp,gas | 1341.10 | J/mol×K | 1103.49 | Joback Calculated Property |
| Cp,gas | 1354.81 | J/mol×K | 1138.56 | Joback Calculated Property |
| η | [0.0000221; 0.0004320] | Pa×s | [510.75; 928.14] |
|
| η | 0.0004320 | Pa×s | 510.75 | Joback Calculated Property |
| η | 0.0001956 | Pa×s | 580.31 | Joback Calculated Property |
| η | 0.0001049 | Pa×s | 649.88 | Joback Calculated Property |
| η | 0.0000635 | Pa×s | 719.44 | Joback Calculated Property |
| η | 0.0000420 | Pa×s | 789.01 | Joback Calculated Property |
| η | 0.0000297 | Pa×s | 858.58 | Joback Calculated Property |
| η | 0.0000221 | Pa×s | 928.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, cis-hex-3-enyl tridecyl ester.
Sources
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