- InChI
- InChI=1S/C14H12O3/c15-11-16-10-12-5-4-8-14(9-12)17-13-6-2-1-3-7-13/h1-9,11H,10H2
- InChI Key
- MJRCKLQMGSPMPF-UHFFFAOYSA-N
- Formula
- C14H12O3
- SMILES
- O=COCc1cccc(Oc2ccccc2)c1
- Molecular Weight1
- 228.24
- 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° | -27.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -220.72 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.51 | kJ/mol | Joback Calculated Property |
| log10WS | -3.27 | Crippen Calculated Property | |
| logPoct/wat | 3.152 | Crippen Calculated Property | |
| McVol | 173.910 | ml/mol | McGowan Calculated Property |
| Pc | 2844.44 | kPa | Joback Calculated Property |
| Inp | 1842.00 | NIST | |
| Tboil | 671.56 | K | Joback Calculated Property |
| Tc | 906.34 | K | Joback Calculated Property |
| Tfus | 399.36 | K | Joback Calculated Property |
| Vc | 0.656 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [440.61; 511.13] | J/mol×K | [671.56; 906.34] | 
|
| Cp,gas | 440.61 | J/mol×K | 671.56 | Joback Calculated Property |
| Cp,gas | 455.00 | J/mol×K | 710.69 | Joback Calculated Property |
| Cp,gas | 468.30 | J/mol×K | 749.82 | Joback Calculated Property |
| Cp,gas | 480.54 | J/mol×K | 788.95 | Joback Calculated Property |
| Cp,gas | 491.74 | J/mol×K | 828.08 | Joback Calculated Property |
| Cp,gas | 501.93 | J/mol×K | 867.21 | Joback Calculated Property |
| Cp,gas | 511.13 | J/mol×K | 906.34 | Joback Calculated Property |
| η | [0.0001312; 0.0010846] | Pa×s | [399.36; 671.56] |
|
| η | 0.0010846 | Pa×s | 399.36 | Joback Calculated Property |
| η | 0.0006374 | Pa×s | 444.73 | Joback Calculated Property |
| η | 0.0004133 | Pa×s | 490.09 | Joback Calculated Property |
| η | 0.0002884 | Pa×s | 535.46 | Joback Calculated Property |
| η | 0.0002129 | Pa×s | 580.83 | Joback Calculated Property |
| η | 0.0001642 | Pa×s | 626.19 | Joback Calculated Property |
| η | 0.0001312 | Pa×s | 671.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Formic acid, (3-phenoxyphenyl)methyl ester.
Sources
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