- InChI
- InChI=1S/C27H38O2/c1-3-4-5-6-7-8-9-10-11-12-23-29-27-21-17-25(18-22-27)14-13-24-15-19-26(28-2)20-16-24/h13-22H,3-12,23H2,1-2H3/b14-13+
- InChI Key
- ZTKXXACFPFBWBM-BUHFOSPRSA-N
- Formula
- C27H38O2
- SMILES
-
CCCCCCCCCCCCOc1ccc(C=Cc2ccc(OC
)cc2)cc1 - Molecular Weight1
- 394.59
- CAS
- 35135-49-0
- 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).
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- 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° | 252.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -297.71 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.35 | kJ/mol | Joback Calculated Property |
| log10WS | -8.92 | Crippen Calculated Property | |
| logPoct/wat | 8.165 | Crippen Calculated Property | |
| McVol | 351.210 | ml/mol | McGowan Calculated Property |
| Pc | 1001.44 | kPa | Joback Calculated Property |
| Tboil | 929.48 | K | Joback Calculated Property |
| Tc | 1143.72 | K | Joback Calculated Property |
| Tfus | 415.00 ± 1.00 | K | NIST |
| Vc | 1.347 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1140.43; 1232.73] | J/mol×K | [929.48; 1143.72] | 
|
| Cp,gas | 1140.43 | J/mol×K | 929.48 | Joback Calculated Property |
| Cp,gas | 1158.86 | J/mol×K | 965.19 | Joback Calculated Property |
| Cp,gas | 1175.98 | J/mol×K | 1000.89 | Joback Calculated Property |
| Cp,gas | 1191.86 | J/mol×K | 1036.60 | Joback Calculated Property |
| Cp,gas | 1206.57 | J/mol×K | 1072.30 | Joback Calculated Property |
| Cp,gas | 1220.17 | J/mol×K | 1108.01 | Joback Calculated Property |
| Cp,gas | 1232.73 | J/mol×K | 1143.72 | Joback Calculated Property |
| η | [0.0000203; 0.0002932] | Pa×s | [511.31; 929.48] |
|
| η | 0.0002932 | Pa×s | 511.31 | Joback Calculated Property |
| η | 0.0001438 | Pa×s | 581.00 | Joback Calculated Property |
| η | 0.0000821 | Pa×s | 650.70 | Joback Calculated Property |
| η | 0.0000523 | Pa×s | 720.39 | Joback Calculated Property |
| η | 0.0000360 | Pa×s | 790.09 | Joback Calculated Property |
| η | 0.0000264 | Pa×s | 859.78 | Joback Calculated Property |
| η | 0.0000203 | Pa×s | 929.48 | Joback Calculated Property |
| ΔfusH | 58.66 | kJ/mol | 415.00 | NIST |
| ΔfusS | 141.30 | J/mol×K | 415.00 | NIST |
Similar Compounds
Find more compounds similar to 4-Methoxy-4'-dodecoxy-trans-stilbene.
Sources
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