- InChI
- InChI=1S/C20H18O2/c1-2-19(16-9-4-3-5-10-16)20(21)22-18-13-12-15-8-6-7-11-17(15)14-18/h3-14,19H,2H2,1H3
- InChI Key
- HIHXLDQNELJQMF-UHFFFAOYSA-N
- Formula
- C20H18O2
- SMILES
-
CCC(C(=O)Oc1ccc2ccccc2c1)c1ccc
cc1 - Molecular Weight1
- 290.36
- 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 | 0.6520 | Relay (1.0) Calculated Property | |
| ΔfG° | 203.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -138.23 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 31.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.27 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.80 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.42 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.939 | Crippen Calculated Property | |
| McVol | 233.120 | ml/mol | McGowan Calculated Property |
| Pc | 2081.22 | kPa | Joback Calculated Property |
| Inp | [2480.00; 2480.00] |
|
|
| Inp | 2480.00 | NIST | |
| Inp | 2480.00 | NIST | |
| Tboil | 671.31 | K | Relay (1.0) Calculated Property |
| Tc | 968.47 | K | Relay (1.0) Calculated Property |
| Tfus | 383.99 | K | Relay (1.0) Calculated Property |
| Vc | 0.830 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [666.42; 742.51] | J/mol×K | [810.17; 1055.99] |
|
| Cp,gas | 666.42 | J/mol×K | 810.17 | Joback Calculated Property |
| Cp,gas | 681.93 | J/mol×K | 851.14 | Joback Calculated Property |
| Cp,gas | 696.16 | J/mol×K | 892.11 | Joback Calculated Property |
| Cp,gas | 709.22 | J/mol×K | 933.08 | Joback Calculated Property |
| Cp,gas | 721.22 | J/mol×K | 974.05 | Joback Calculated Property |
| Cp,gas | 732.28 | J/mol×K | 1015.02 | Joback Calculated Property |
| Cp,gas | 742.51 | J/mol×K | 1055.99 | Joback Calculated Property |
| η | [0.0001346; 0.0010632] | Pa×s | [470.38; 810.17] |
|
| η | 0.0010632 | Pa×s | 470.38 | Joback Calculated Property |
| η | 0.0006261 | Pa×s | 527.01 | Joback Calculated Property |
| η | 0.0004086 | Pa×s | 583.64 | Joback Calculated Property |
| η | 0.0002876 | Pa×s | 640.27 | Joback Calculated Property |
| η | 0.0002143 | Pa×s | 696.91 | Joback Calculated Property |
| η | 0.0001669 | Pa×s | 753.54 | Joback Calculated Property |
| η | 0.0001346 | Pa×s | 810.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Butyric acid, 2-phenyl-, naphth-2-yl ester.
Sources
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