- InChI
- InChI=1S/C24H24O4/c1-17(2)8-7-15-27-23(25)19-11-5-12-20(16-19)24(26)28-22-14-6-10-18-9-3-4-13-21(18)22/h3-6,9-14,16-17H,7-8,15H2,1-2H3
- InChI Key
- XQIVTXAUQWDSGD-UHFFFAOYSA-N
- Formula
- C24H24O4
- SMILES
-
CC(C)CCCOC(=O)c1cccc(C(=O)Oc2c
ccc3ccccc23)c1 - Molecular Weight1
- 376.44
- 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° | -6.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -392.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.46 | kJ/mol | Joback Calculated Property |
| log10WS | -7.46 | Crippen Calculated Property | |
| logPoct/wat | 5.652 | Crippen Calculated Property | |
| McVol | 296.920 | ml/mol | McGowan Calculated Property |
| Pc | 1543.92 | kPa | Joback Calculated Property |
| Inp | [3241.00; 3241.00] |
|
|
| Inp | 3241.00 | NIST | |
| Inp | 3241.00 | NIST | |
| Tboil | 982.96 | K | Joback Calculated Property |
| Tc | 1221.48 | K | Joback Calculated Property |
| Tfus | 600.14 | K | Joback Calculated Property |
| Vc | 1.127 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [933.41; 995.12] | J/mol×K | [982.96; 1221.48] |
|
| Cp,gas | 933.41 | J/mol×K | 982.96 | Joback Calculated Property |
| Cp,gas | 946.49 | J/mol×K | 1022.71 | Joback Calculated Property |
| Cp,gas | 958.33 | J/mol×K | 1062.47 | Joback Calculated Property |
| Cp,gas | 969.03 | J/mol×K | 1102.22 | Joback Calculated Property |
| Cp,gas | 978.67 | J/mol×K | 1141.97 | Joback Calculated Property |
| Cp,gas | 987.34 | J/mol×K | 1181.73 | Joback Calculated Property |
| Cp,gas | 995.12 | J/mol×K | 1221.48 | Joback Calculated Property |
| η | [0.0000619; 0.0004371] | Pa×s | [600.14; 982.96] |
|
| η | 0.0004371 | Pa×s | 600.14 | Joback Calculated Property |
| η | 0.0002699 | Pa×s | 663.94 | Joback Calculated Property |
| η | 0.0001813 | Pa×s | 727.75 | Joback Calculated Property |
| η | 0.0001299 | Pa×s | 791.55 | Joback Calculated Property |
| η | 0.0000978 | Pa×s | 855.35 | Joback Calculated Property |
| η | 0.0000766 | Pa×s | 919.16 | Joback Calculated Property |
| η | 0.0000619 | Pa×s | 982.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, isohexyl 1-naphthyl ester.
Sources
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