- InChI
- InChI=1S/C24H22O4/c1-3-7-23(25)27-21-15-11-19(12-16-21)9-5-6-10-20-13-17-22(18-14-20)28-24(26)8-4-2/h11-18H,3-4,7-8H2,1-2H3
- InChI Key
- HEEINBGBKKELRM-UHFFFAOYSA-N
- Formula
- C24H22O4
- SMILES
-
CCCC(=O)Oc1ccc(C#CC#Cc2ccc(OC(
=O)CCC)cc2)cc1 - Molecular Weight1
- 374.43
- CAS
- 92341-25-8
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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° | 294.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -33.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 57.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.51 | kJ/mol | Joback Calculated Property |
| log10WS | -6.82 | Crippen Calculated Property | |
| logPoct/wat | 4.501 | Crippen Calculated Property | |
| McVol | 299.180 | ml/mol | McGowan Calculated Property |
| Pc | 1628.54 | kPa | Joback Calculated Property |
| Tboil | 982.42 | K | Joback Calculated Property |
| Tc | 1231.60 | K | Joback Calculated Property |
| Tfus | 794.64 | K | Joback Calculated Property |
| Vc | 1.135 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [901.59; 956.17] | J/mol×K | [982.42; 1231.60] | 
|
| Cp,gas | 901.59 | J/mol×K | 982.42 | Joback Calculated Property |
| Cp,gas | 914.34 | J/mol×K | 1023.95 | Joback Calculated Property |
| Cp,gas | 925.56 | J/mol×K | 1065.48 | Joback Calculated Property |
| Cp,gas | 935.32 | J/mol×K | 1107.01 | Joback Calculated Property |
| Cp,gas | 943.64 | J/mol×K | 1148.54 | Joback Calculated Property |
| Cp,gas | 950.57 | J/mol×K | 1190.07 | Joback Calculated Property |
| Cp,gas | 956.17 | J/mol×K | 1231.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4,4'-Dibutanoyloxydiphenyldiacetylene.
Sources
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