- InChI
- InChI=1S/C10H10O2/c11-9-12-8-4-7-10-5-2-1-3-6-10/h1-7,9H,8H2/b7-4+
- InChI Key
- LBHJXKYRYCUGPD-QPJJXVBHSA-N
- Formula
- C10H10O2
- SMILES
- O=COCC=Cc1ccccc1
- Molecular Weight1
- 162.19
- CAS
- 104-65-4
- Other Names
-
- Cinnamyl alcohol, formate
- «gamma»-Phenylallyl formate
- Cinnamyl formate
- Cinnamyl methanoate
- Formic acid, cinnamyl ester
- 3-Phenyl-2-propen-1-yl formate
- 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° | 21.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -113.78 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.22 | kJ/mol | Joback Calculated Property |
| log10WS | -1.99 | Crippen Calculated Property | |
| logPoct/wat | 1.873 | Crippen Calculated Property | |
| McVol | 131.140 | ml/mol | McGowan Calculated Property |
| Pc | 3310.55 | kPa | Joback Calculated Property |
| Inp | [1330.00; 1332.00] |
|
|
| Inp | 1332.00 | NIST | |
| Inp | 1332.00 | NIST | |
| Inp | 1330.00 | NIST | |
| Inp | 1330.00 | NIST | |
| Inp | 1330.00 | NIST | |
| I | [2094.00; 2094.00] |
|
|
| I | 2094.00 | NIST | |
| I | 2094.00 | NIST | |
| I | 2094.00 | NIST | |
| Tboil | 530.12 | K | Joback Calculated Property |
| Tc | 747.33 | K | Joback Calculated Property |
| Tfus | 288.03 | K | Joback Calculated Property |
| Vc | 0.502 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [283.09; 347.92] | J/mol×K | [530.12; 747.33] |
|
| Cp,gas | 283.09 | J/mol×K | 530.12 | Joback Calculated Property |
| Cp,gas | 295.79 | J/mol×K | 566.32 | Joback Calculated Property |
| Cp,gas | 307.68 | J/mol×K | 602.52 | Joback Calculated Property |
| Cp,gas | 318.81 | J/mol×K | 638.72 | Joback Calculated Property |
| Cp,gas | 329.20 | J/mol×K | 674.93 | Joback Calculated Property |
| Cp,gas | 338.89 | J/mol×K | 711.13 | Joback Calculated Property |
| Cp,gas | 347.92 | J/mol×K | 747.33 | Joback Calculated Property |
| η | [0.0001995; 0.0024293] | Pa×s | [288.03; 530.12] |
|
| η | 0.0024293 | Pa×s | 288.03 | Joback Calculated Property |
| η | 0.0012400 | Pa×s | 328.38 | Joback Calculated Property |
| η | 0.0007333 | Pa×s | 368.73 | Joback Calculated Property |
| η | 0.0004810 | Pa×s | 409.08 | Joback Calculated Property |
| η | 0.0003403 | Pa×s | 449.42 | Joback Calculated Property |
| η | 0.0002549 | Pa×s | 489.77 | Joback Calculated Property |
| η | 0.0001995 | Pa×s | 530.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Propen-1-ol, 3-phenyl-, formate.
Sources
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