- InChI
- InChI=1S/C18H26O4/c1-4-5-13-21-17(19)11-6-7-12-18(20)22-16-10-8-9-14(2)15(16)3/h8-10H,4-7,11-13H2,1-3H3
- InChI Key
- OODLUFCFTUJGAK-UHFFFAOYSA-N
- Formula
- C18H26O4
- SMILES
-
CCCCOC(=O)CCCCC(=O)Oc1cccc(C)c
1C - Molecular Weight1
- 306.40
- 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 | 0.8976 | Relay (1.0) Calculated Property | |
| ΔfG° | -274.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -813.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 41.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.14 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.24 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.113 | Crippen Calculated Property | |
| McVol | 255.600 | ml/mol | McGowan Calculated Property |
| Pc | 1534.26 | kPa | Joback Calculated Property |
| Inp | 2280.00 | NIST | |
| Tboil | 618.99 | K | Relay (1.0) Calculated Property |
| Tc | 820.52 | K | Relay (1.0) Calculated Property |
| Tfus | 294.46 | K | Relay (1.0) Calculated Property |
| Vc | 0.953 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [760.53; 838.68] | J/mol×K | [800.46; 1000.95] | 
|
| Cp,gas | 760.53 | J/mol×K | 800.46 | Joback Calculated Property |
| Cp,gas | 776.12 | J/mol×K | 833.88 | Joback Calculated Property |
| Cp,gas | 790.66 | J/mol×K | 867.29 | Joback Calculated Property |
| Cp,gas | 804.18 | J/mol×K | 900.71 | Joback Calculated Property |
| Cp,gas | 816.68 | J/mol×K | 934.12 | Joback Calculated Property |
| Cp,gas | 828.18 | J/mol×K | 967.54 | Joback Calculated Property |
| Cp,gas | 838.68 | J/mol×K | 1000.95 | Joback Calculated Property |
| η | [0.0000726; 0.0006133] | Pa×s | [488.40; 800.46] |
|
| η | 0.0006133 | Pa×s | 488.40 | Joback Calculated Property |
| η | 0.0003622 | Pa×s | 540.41 | Joback Calculated Property |
| η | 0.0002346 | Pa×s | 592.42 | Joback Calculated Property |
| η | 0.0001630 | Pa×s | 644.43 | Joback Calculated Property |
| η | 0.0001196 | Pa×s | 696.44 | Joback Calculated Property |
| η | 0.0000916 | Pa×s | 748.45 | Joback Calculated Property |
| η | 0.0000726 | Pa×s | 800.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, butyl 2,3-dimethylphenyl ester.
Sources
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