- InChI
- InChI=1S/C11H12O2/c1-3-4-10-5-7-11(8-6-10)13-9(2)12/h3,5-8H,1,4H2,2H3
- InChI Key
- AXHHVVBUOKYKJO-UHFFFAOYSA-N
- Formula
- C11H12O2
- SMILES
- C=CCc1ccc(OC(C)=O)cc1
- Molecular Weight1
- 176.21
- CAS
- 61499-22-7
- Other Names
-
- 4-Allylphenyl acetate
- Chavicol, acetate
- 4-(2-Propenyl)phenyl acetate
- 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.
- I : 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° | -1.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -164.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.50 | kJ/mol | Joback Calculated Property |
| log10WS | -2.86 | Crippen Calculated Property | |
| logPoct/wat | 2.340 | Crippen Calculated Property | |
| McVol | 145.230 | ml/mol | McGowan Calculated Property |
| Pc | 2859.68 | kPa | Joback Calculated Property |
| Inp | [1309.00; 1350.60] |
|
|
| Inp | 1309.00 | NIST | |
| Inp | 1314.00 | NIST | |
| Inp | 1350.60 | NIST | |
| Inp | 1322.00 | NIST | |
| Inp | 1315.00 | NIST | |
| Inp | 1309.00 | NIST | |
| Inp | 1322.00 | NIST | |
| Inp | 1350.60 | NIST | |
| I | 1949.00 | NIST | |
| Tboil | 555.71 | K | Joback Calculated Property |
| Tc | 770.47 | K | Joback Calculated Property |
| Tfus | 323.07 | K | Joback Calculated Property |
| Vc | 0.548 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [326.57; 396.28] | J/mol×K | [555.71; 770.47] |
|
| Cp,gas | 326.57 | J/mol×K | 555.71 | Joback Calculated Property |
| Cp,gas | 340.05 | J/mol×K | 591.50 | Joback Calculated Property |
| Cp,gas | 352.75 | J/mol×K | 627.30 | Joback Calculated Property |
| Cp,gas | 364.71 | J/mol×K | 663.09 | Joback Calculated Property |
| Cp,gas | 375.94 | J/mol×K | 698.88 | Joback Calculated Property |
| Cp,gas | 386.46 | J/mol×K | 734.67 | Joback Calculated Property |
| Cp,gas | 396.28 | J/mol×K | 770.47 | Joback Calculated Property |
| η | [0.0002008; 0.0016626] | Pa×s | [323.07; 555.71] |
|
| η | 0.0016626 | Pa×s | 323.07 | Joback Calculated Property |
| η | 0.0009678 | Pa×s | 361.84 | Joback Calculated Property |
| η | 0.0006256 | Pa×s | 400.62 | Joback Calculated Property |
| η | 0.0004367 | Pa×s | 439.39 | Joback Calculated Property |
| η | 0.0003232 | Pa×s | 478.16 | Joback Calculated Property |
| η | 0.0002502 | Pa×s | 516.94 | Joback Calculated Property |
| η | 0.0002008 | Pa×s | 555.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 4-(2-propenyl)-, acetate.
Sources
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