- InChI
- InChI=1S/C24H24O3/c1-2-3-7-19-10-12-21(13-11-19)24(25)27-23-16-14-22(15-17-23)26-18-20-8-5-4-6-9-20/h4-6,8-17H,2-3,7,18H2,1H3
- InChI Key
- XGUHUAHNDPETLF-UHFFFAOYSA-N
- Formula
- C24H24O3
- SMILES
-
CCCCc1ccc(C(=O)Oc2ccc(OCc3cccc
c3)cc2)cc1 - Molecular Weight1
- 360.45
- 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 | 0.9216 | Relay (1.0) Calculated Property | |
| ΔfG° | 53.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -279.18 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 44.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 120.12 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.10 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.827 | Crippen Calculated Property | |
| McVol | 291.050 | ml/mol | McGowan Calculated Property |
| Pc | 1512.85 | kPa | Joback Calculated Property |
| Inp | 3197.00 | NIST | |
| Tboil | 718.12 | K | Relay (1.0) Calculated Property |
| Tc | 983.18 | K | Relay (1.0) Calculated Property |
| Tfus | 332.06 | K | Relay (1.0) Calculated Property |
| Vc | 1.063 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [894.62; 959.80] | J/mol×K | [919.36; 1157.35] | 
|
| Cp,gas | 894.62 | J/mol×K | 919.36 | Joback Calculated Property |
| Cp,gas | 909.12 | J/mol×K | 959.03 | Joback Calculated Property |
| Cp,gas | 922.06 | J/mol×K | 998.69 | Joback Calculated Property |
| Cp,gas | 933.53 | J/mol×K | 1038.36 | Joback Calculated Property |
| Cp,gas | 943.60 | J/mol×K | 1078.02 | Joback Calculated Property |
| Cp,gas | 952.33 | J/mol×K | 1117.69 | Joback Calculated Property |
| Cp,gas | 959.80 | J/mol×K | 1157.35 | Joback Calculated Property |
| η | [0.0000305; 0.0003610] | Pa×s | [529.10; 919.36] |
|
| η | 0.0003610 | Pa×s | 529.10 | Joback Calculated Property |
| η | 0.0001909 | Pa×s | 594.14 | Joback Calculated Property |
| η | 0.0001144 | Pa×s | 659.19 | Joback Calculated Property |
| η | 0.0000752 | Pa×s | 724.23 | Joback Calculated Property |
| η | 0.0000530 | Pa×s | 789.27 | Joback Calculated Property |
| η | 0.0000394 | Pa×s | 854.32 | Joback Calculated Property |
| η | 0.0000305 | Pa×s | 919.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Butylbenzoic acid, 4-benzyloxyphenyl ester.
Sources
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