- InChI
- InChI=1S/C30H46O4/c1-3-5-7-9-11-13-15-17-19-24-33-29(31)27-22-21-23-28(26-27)30(32)34-25-20-18-16-14-12-10-8-6-4-2/h17-23,26H,3-16,24-25H2,1-2H3/b19-17+,20-18+
- InChI Key
- YHWOVSJMYXLLGW-XPWSMXQVSA-N
- Formula
- C30H46O4
- SMILES
-
CCCCCCCCC=CCOC(=O)c1cccc(C(=O)
OCC=CCCCCCCCC)c1 - Molecular Weight1
- 470.68
- 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 | 1.2195 | Relay (1.0) Calculated Property | |
| ΔfG° | -2.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -922.48 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 73.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 131.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.98 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.51 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.614 | Crippen Calculated Property | |
| McVol | 416.080 | ml/mol | McGowan Calculated Property |
| Pc | 777.64 | kPa | Joback Calculated Property |
| Inp | [3483.00; 3483.00] |
|
|
| Inp | 3483.00 | NIST | |
| Inp | 3483.00 | NIST | |
| Tboil | 701.09 | K | Relay (1.0) Calculated Property |
| Tc | 908.04 | K | Relay (1.0) Calculated Property |
| Tfus | 289.01 | K | Relay (1.0) Calculated Property |
| Vc | 1.508 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1439.49; 1533.65] | J/mol×K | [1078.36; 1328.34] |
|
| Cp,gas | 1439.49 | J/mol×K | 1078.36 | Joback Calculated Property |
| Cp,gas | 1458.44 | J/mol×K | 1120.02 | Joback Calculated Property |
| Cp,gas | 1475.90 | J/mol×K | 1161.69 | Joback Calculated Property |
| Cp,gas | 1492.02 | J/mol×K | 1203.35 | Joback Calculated Property |
| Cp,gas | 1506.93 | J/mol×K | 1245.02 | Joback Calculated Property |
| Cp,gas | 1520.76 | J/mol×K | 1286.68 | Joback Calculated Property |
| Cp,gas | 1533.65 | J/mol×K | 1328.34 | Joback Calculated Property |
| η | [0.0000095; 0.0001569] | Pa×s | [600.96; 1078.36] |
|
| η | 0.0001569 | Pa×s | 600.96 | Joback Calculated Property |
| η | 0.0000748 | Pa×s | 680.53 | Joback Calculated Property |
| η | 0.0000417 | Pa×s | 760.09 | Joback Calculated Property |
| η | 0.0000259 | Pa×s | 839.66 | Joback Calculated Property |
| η | 0.0000175 | Pa×s | 919.23 | Joback Calculated Property |
| η | 0.0000126 | Pa×s | 998.79 | Joback Calculated Property |
| η | 0.0000095 | Pa×s | 1078.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, di(undec-2-en-1-yl) ester.
Sources
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