- InChI
- InChI=1S/C10H12O2/c1-2-10(12-8-11)9-6-4-3-5-7-9/h3-8,10H,2H2,1H3
- InChI Key
- BSYHSYBKNKZGNL-UHFFFAOYSA-N
- Formula
- C10H12O2
- SMILES
- CCC(OC=O)c1ccccc1
- Molecular Weight1
- 164.20
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.4668 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -296.10 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 18.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.12 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.28 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.311 | Crippen Calculated Property | |
| McVol | 135.440 | ml/mol | McGowan Calculated Property |
| Pc | 3012.33 | kPa | Joback Calculated Property |
| Inp | 1223.00 | NIST | |
| Tboil | 483.68 | K | Relay (1.0) Calculated Property |
| Tc | 699.97 | K | Relay (1.0) Calculated Property |
| Tfus | 256.91 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [288.76; 355.82] | J/mol×K | [512.16; 723.28] | 
|
| Cp,gas | 288.76 | J/mol×K | 512.16 | Joback Calculated Property |
| Cp,gas | 302.04 | J/mol×K | 547.35 | Joback Calculated Property |
| Cp,gas | 314.41 | J/mol×K | 582.53 | Joback Calculated Property |
| Cp,gas | 325.92 | J/mol×K | 617.72 | Joback Calculated Property |
| Cp,gas | 336.63 | J/mol×K | 652.91 | Joback Calculated Property |
| Cp,gas | 346.58 | J/mol×K | 688.10 | Joback Calculated Property |
| Cp,gas | 355.82 | J/mol×K | 723.28 | Joback Calculated Property |
| η | [0.0003569; 0.0030963] | Pa×s | [272.58; 512.16] |
|
| η | 0.0030963 | Pa×s | 272.58 | Joback Calculated Property |
| η | 0.0017162 | Pa×s | 312.51 | Joback Calculated Property |
| η | 0.0010873 | Pa×s | 352.44 | Joback Calculated Property |
| η | 0.0007560 | Pa×s | 392.37 | Joback Calculated Property |
| η | 0.0005621 | Pa×s | 432.30 | Joback Calculated Property |
| η | 0.0004394 | Pa×s | 472.23 | Joback Calculated Property |
| η | 0.0003569 | Pa×s | 512.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Formic acid, 1-phenylpropyl ester.
Sources
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