- InChI
- InChI=1S/C16H14O2/c17-16(15-11-5-2-6-12-15)18-13-7-10-14-8-3-1-4-9-14/h1-12H,13H2/b10-7-
- InChI Key
- UARVBDPGNUHYQT-YFHOEESVSA-N
- Formula
- C16H14O2
- SMILES
- O=C(OCC=Cc1ccccc1)c1ccccc1
- Molecular Weight1
- 238.28
- CAS
- 117204-78-1
- 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° | 154.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -28.09 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.88 | kJ/mol | Joback Calculated Property |
| log10WS | -4.19 | Crippen Calculated Property | |
| logPoct/wat | 3.557 | Crippen Calculated Property | |
| McVol | 191.920 | ml/mol | McGowan Calculated Property |
| Pc | 2515.07 | kPa | Joback Calculated Property |
| Inp | [2015.80; 2015.80] |
|
|
| Inp | 2015.80 | NIST | |
| Inp | 2015.80 | NIST | |
| Tboil | 699.29 | K | Joback Calculated Property |
| Tc | 941.67 | K | Joback Calculated Property |
| Tfus | 390.00 | K | Joback Calculated Property |
| Vc | 0.720 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [495.69; 571.63] | J/mol×K | [699.29; 941.67] |
|
| Cp,gas | 495.69 | J/mol×K | 699.29 | Joback Calculated Property |
| Cp,gas | 511.23 | J/mol×K | 739.69 | Joback Calculated Property |
| Cp,gas | 525.51 | J/mol×K | 780.08 | Joback Calculated Property |
| Cp,gas | 538.61 | J/mol×K | 820.48 | Joback Calculated Property |
| Cp,gas | 550.60 | J/mol×K | 860.88 | Joback Calculated Property |
| Cp,gas | 561.58 | J/mol×K | 901.28 | Joback Calculated Property |
| Cp,gas | 571.63 | J/mol×K | 941.67 | Joback Calculated Property |
| η | [0.0001055; 0.0013204] | Pa×s | [390.00; 699.29] |
|
| η | 0.0013204 | Pa×s | 390.00 | Joback Calculated Property |
| η | 0.0006777 | Pa×s | 441.55 | Joback Calculated Property |
| η | 0.0003999 | Pa×s | 493.10 | Joback Calculated Property |
| η | 0.0002607 | Pa×s | 544.64 | Joback Calculated Property |
| η | 0.0001830 | Pa×s | 596.19 | Joback Calculated Property |
| η | 0.0001359 | Pa×s | 647.74 | Joback Calculated Property |
| η | 0.0001055 | Pa×s | 699.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-Cinnamyl benzoate.
Sources
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