- InChI
- InChI=1S/C20H16O2/c21-20(19-13-18(19)15-7-2-1-3-8-15)22-17-11-10-14-6-4-5-9-16(14)12-17/h1-12,18-19H,13H2
- InChI Key
- MMVXWBSBJVZZLD-UHFFFAOYSA-N
- Formula
- C20H16O2
- SMILES
-
O=C(Oc1ccc2ccccc2c1)C1CC1c1ccc
cc1 - Molecular Weight1
- 288.34
- 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 | 0.6169 | Relay (1.0) Calculated Property | |
| ΔfG° | 258.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -13.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.88 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.82 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.30 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.549 | Crippen Calculated Property | |
| McVol | 222.260 | ml/mol | McGowan Calculated Property |
| Pc | 2261.11 | kPa | Joback Calculated Property |
| Inp | 2695.00 | NIST | |
| Tboil | 677.66 | K | Relay (1.0) Calculated Property |
| Tc | 1009.81 | K | Relay (1.0) Calculated Property |
| Tfus | 377.94 | K | Relay (1.0) Calculated Property |
| Vc | 0.817 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [652.77; 732.40] | J/mol×K | [812.68; 1068.89] | 
|
| Cp,gas | 652.77 | J/mol×K | 812.68 | Joback Calculated Property |
| Cp,gas | 668.75 | J/mol×K | 855.38 | Joback Calculated Property |
| Cp,gas | 683.44 | J/mol×K | 898.08 | Joback Calculated Property |
| Cp,gas | 696.99 | J/mol×K | 940.78 | Joback Calculated Property |
| Cp,gas | 709.56 | J/mol×K | 983.48 | Joback Calculated Property |
| Cp,gas | 721.31 | J/mol×K | 1026.19 | Joback Calculated Property |
| Cp,gas | 732.40 | J/mol×K | 1068.89 | Joback Calculated Property |
| η | [0.0005643; 0.0018227] | Pa×s | [499.08; 812.68] |
|
| η | 0.0018227 | Pa×s | 499.08 | Joback Calculated Property |
| η | 0.0013666 | Pa×s | 551.35 | Joback Calculated Property |
| η | 0.0010770 | Pa×s | 603.61 | Joback Calculated Property |
| η | 0.0008816 | Pa×s | 655.88 | Joback Calculated Property |
| η | 0.0007433 | Pa×s | 708.15 | Joback Calculated Property |
| η | 0.0006415 | Pa×s | 760.41 | Joback Calculated Property |
| η | 0.0005643 | Pa×s | 812.68 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopropanecarboxylic acid, trans-2-phenyl-, naphth-2-yl ester.
Sources
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