- InChI
- InChI=1S/C18H26O4/c1-11(2)13(5)21-17(19)15-9-7-8-10-16(15)18(20)22-14(6)12(3)4/h7-14H,1-6H3
- InChI Key
- KYBCYUKYPGQBSB-UHFFFAOYSA-N
- Formula
- C18H26O4
- SMILES
-
CC(C)C(C)OC(=O)c1ccccc1C(=O)OC
(C)C(C)C - Molecular Weight1
- 306.40
- Other Names
-
- 1,2-Benzenedicarboxylic acid, bis(3-methylbutan-2-yl) ester
- Bis(3-methylbutan-2-yl)-1,2-benzenedicarboxylate
- 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° | -274.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -700.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.36 | kJ/mol | Joback Calculated Property |
| log10WS | -5.05 | Crippen Calculated Property | |
| logPoct/wat | 4.089 | Crippen Calculated Property | |
| McVol | 255.600 | ml/mol | McGowan Calculated Property |
| Pc | 1592.35 | kPa | Joback Calculated Property |
| Inp | [1991.00; 1991.00] |
|
|
| Inp | 1991.00 | NIST | |
| Inp | 1991.00 | NIST | |
| Tboil | 793.72 | K | Joback Calculated Property |
| Tc | 1003.71 | K | Joback Calculated Property |
| Tfus | 415.88 | K | Joback Calculated Property |
| Vc | 0.960 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [763.39; 844.67] | J/mol×K | [793.72; 1003.71] |
|
| Cp,gas | 763.39 | J/mol×K | 793.72 | Joback Calculated Property |
| Cp,gas | 779.87 | J/mol×K | 828.72 | Joback Calculated Property |
| Cp,gas | 795.15 | J/mol×K | 863.72 | Joback Calculated Property |
| Cp,gas | 809.25 | J/mol×K | 898.71 | Joback Calculated Property |
| Cp,gas | 822.19 | J/mol×K | 933.71 | Joback Calculated Property |
| Cp,gas | 833.99 | J/mol×K | 968.71 | Joback Calculated Property |
| Cp,gas | 844.67 | J/mol×K | 1003.71 | Joback Calculated Property |
| η | [0.0000514; 0.0013805] | Pa×s | [415.88; 793.72] |
|
| η | 0.0013805 | Pa×s | 415.88 | Joback Calculated Property |
| η | 0.0005561 | Pa×s | 478.85 | Joback Calculated Property |
| η | 0.0002768 | Pa×s | 541.83 | Joback Calculated Property |
| η | 0.0001593 | Pa×s | 604.80 | Joback Calculated Property |
| η | 0.0001017 | Pa×s | 667.77 | Joback Calculated Property |
| η | 0.0000702 | Pa×s | 730.75 | Joback Calculated Property |
| η | 0.0000514 | Pa×s | 793.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Bis(3-methylbutan-2-yl) phthalate.
Sources
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