- InChI
- InChI=1S/C15H18O2/c1-2-3-4-8-13-17-15(16)12-11-14-9-6-5-7-10-14/h3-7,9-12H,2,8,13H2,1H3/b4-3-,12-11+
- InChI Key
- FKWGVMQNGUQXDN-FECXASIGSA-N
- Formula
- C15H18O2
- SMILES
- CCC=CCCOC(=O)C=Cc1ccccc1
- Molecular Weight1
- 230.30
- CAS
- 68133-75-5
- Other Names
-
- Cinnamic acid cis-3-hexenyl ester
- 2-Propenoic acid, 3-phenyl-, 3(Z)-hexenyl ester
- Cinnamic acid, (Z)-3-hexenyl ester
- (3Z)-3-Hexenyl 3-phenyl-2-propenoate
- (Z)-3-hexenyl cinnamate
- (Z)-3-Hexenyl cinnamic ester
- 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 | 0.5490 | Relay (1.0) Calculated Property | |
| ΔfG° | 114.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -267.68 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 31.84 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.45 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.68 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.48 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.599 | Crippen Calculated Property | |
| McVol | 197.290 | ml/mol | McGowan Calculated Property |
| Pc | 2110.00 | kPa | Joback Calculated Property |
| Inp | 1897.00 | NIST | |
| Tboil | 580.75 | K | Relay (1.0) Calculated Property |
| Tc | 777.44 | K | Relay (1.0) Calculated Property |
| Tfus | 276.53 | K | Relay (1.0) Calculated Property |
| Vc | 0.686 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [503.36; 584.19] | J/mol×K | [653.89; 866.88] | 
|
| Cp,gas | 503.36 | J/mol×K | 653.89 | Joback Calculated Property |
| Cp,gas | 519.14 | J/mol×K | 689.39 | Joback Calculated Property |
| Cp,gas | 533.92 | J/mol×K | 724.89 | Joback Calculated Property |
| Cp,gas | 547.75 | J/mol×K | 760.38 | Joback Calculated Property |
| Cp,gas | 560.70 | J/mol×K | 795.88 | Joback Calculated Property |
| Cp,gas | 572.83 | J/mol×K | 831.38 | Joback Calculated Property |
| Cp,gas | 584.19 | J/mol×K | 866.88 | Joback Calculated Property |
| η | [0.0001006; 0.0016634] | Pa×s | [347.23; 653.89] |
|
| η | 0.0016634 | Pa×s | 347.23 | Joback Calculated Property |
| η | 0.0007721 | Pa×s | 398.34 | Joback Calculated Property |
| η | 0.0004267 | Pa×s | 449.45 | Joback Calculated Property |
| η | 0.0002662 | Pa×s | 500.56 | Joback Calculated Property |
| η | 0.0001813 | Pa×s | 551.67 | Joback Calculated Property |
| η | 0.0001317 | Pa×s | 602.78 | Joback Calculated Property |
| η | 0.0001006 | Pa×s | 653.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-3-Hexenylcinnamate.
Sources
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