- InChI
- InChI=1S/C29H42O4/c1-3-5-7-9-10-11-12-14-24-31-26-17-15-25(16-18-26)29(30)33-28-21-19-27(20-22-28)32-23-13-8-6-4-2/h15-22H,3-14,23-24H2,1-2H3
- InChI Key
- JBMARNOUPBCWIL-UHFFFAOYSA-N
- Formula
- C29H43O4
- SMILES
-
CCCCCCCCCCOc1ccc(C(=O)Oc2ccc(O
CCCCCC)cc2)cc1 - Molecular Weight1
- 455.65
- CAS
- 68162-09-4
- Other Names
-
- 4-n-Hexoxyphenyl-4'-n-decyloxybenzoate
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (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).
- 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° | -45.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -701.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 63.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.00 | kJ/mol | Joback Calculated Property |
| log10WS | -9.66 | Crippen Calculated Property | |
| logPoct/wat | 8.384 | Crippen Calculated Property | |
| McVol | 391.130 | ml/mol | McGowan Calculated Property |
| Pc | 886.83 | kPa | Joback Calculated Property |
| Tboil | 1047.37 | K | Joback Calculated Property |
| Tc | 1283.00 | K | Joback Calculated Property |
| Tfus | 611.09 | K | Joback Calculated Property |
| Vc | 1.504 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1338.57; 1407.09] | J/mol×K | [1047.37; 1283.00] | 
|
| Cp,gas | 1338.57 | J/mol×K | 1047.37 | Joback Calculated Property |
| Cp,gas | 1354.45 | J/mol×K | 1086.64 | Joback Calculated Property |
| Cp,gas | 1368.46 | J/mol×K | 1125.91 | Joback Calculated Property |
| Cp,gas | 1380.68 | J/mol×K | 1165.19 | Joback Calculated Property |
| Cp,gas | 1391.15 | J/mol×K | 1204.46 | Joback Calculated Property |
| Cp,gas | 1399.93 | J/mol×K | 1243.73 | Joback Calculated Property |
| Cp,gas | 1407.09 | J/mol×K | 1283.00 | Joback Calculated Property |
| η | [0.0000120; 0.0001417] | Pa×s | [611.09; 1047.37] |
|
| η | 0.0001417 | Pa×s | 611.09 | Joback Calculated Property |
| η | 0.0000755 | Pa×s | 683.80 | Joback Calculated Property |
| η | 0.0000454 | Pa×s | 756.52 | Joback Calculated Property |
| η | 0.0000298 | Pa×s | 829.23 | Joback Calculated Property |
| η | 0.0000210 | Pa×s | 901.94 | Joback Calculated Property |
| η | 0.0000156 | Pa×s | 974.66 | Joback Calculated Property |
| η | 0.0000120 | Pa×s | 1047.37 | Joback Calculated Property |
| ΔfusH | 31.70 | kJ/mol | 334.85 | NIST |
Similar Compounds
Find more compounds similar to 4-(n-Decyloxy)benzoic acid,4-(n-hexyloxy)phenyl ether.
Sources
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