- InChI
- InChI=1S/C11H12O3/c1-2-3-11(13)14-10-6-4-9(8-12)5-7-10/h4-8H,2-3H2,1H3
- InChI Key
- DAFTVVBQFUITOL-UHFFFAOYSA-N
- Formula
- C11H12O3
- SMILES
- CCCC(=O)Oc1ccc(C=O)cc1
- Molecular Weight1
- 192.21
- CAS
- 50262-49-2
- Other Names
-
- Butanoic acid, 4-formylphenyl ester
- 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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° | -188.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -375.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.89 | kJ/mol | Joback Calculated Property |
| log10WS | -2.86 | Crippen Calculated Property | |
| logPoct/wat | 2.205 | Crippen Calculated Property | |
| McVol | 151.100 | ml/mol | McGowan Calculated Property |
| Pc | 2960.12 | kPa | Joback Calculated Property |
| Tboil | 607.69 | K | Joback Calculated Property |
| Tc | 820.81 | K | Joback Calculated Property |
| Tfus | 366.83 | K | Joback Calculated Property |
| Vc | 0.585 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [363.60; 428.22] | J/mol×K | [607.69; 820.81] | 
|
| Cp,gas | 363.60 | J/mol×K | 607.69 | Joback Calculated Property |
| Cp,gas | 376.20 | J/mol×K | 643.21 | Joback Calculated Property |
| Cp,gas | 388.04 | J/mol×K | 678.73 | Joback Calculated Property |
| Cp,gas | 399.15 | J/mol×K | 714.25 | Joback Calculated Property |
| Cp,gas | 409.54 | J/mol×K | 749.77 | Joback Calculated Property |
| Cp,gas | 419.22 | J/mol×K | 785.29 | Joback Calculated Property |
| Cp,gas | 428.22 | J/mol×K | 820.81 | Joback Calculated Property |
| η | [0.0002284; 0.0017588] | Pa×s | [366.83; 607.69] |
|
| η | 0.0017588 | Pa×s | 366.83 | Joback Calculated Property |
| η | 0.0010582 | Pa×s | 406.97 | Joback Calculated Property |
| η | 0.0006975 | Pa×s | 447.12 | Joback Calculated Property |
| η | 0.0004925 | Pa×s | 487.26 | Joback Calculated Property |
| η | 0.0003666 | Pa×s | 527.40 | Joback Calculated Property |
| η | 0.0002846 | Pa×s | 567.55 | Joback Calculated Property |
| η | 0.0002284 | Pa×s | 607.69 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 408.50 ± 1.50 | K | 0.10 | NIST |
Similar Compounds
Find more compounds similar to p-Butyryloxybenzaldehyde.
Sources
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