- InChI
- InChI=1S/C10H10O3/c1-2-10(12)13-9-5-3-8(7-11)4-6-9/h3-7H,2H2,1H3
- InChI Key
- NKXPJXVTMWLHBC-UHFFFAOYSA-N
- Formula
- C10H10O3
- SMILES
- CCC(=O)Oc1ccc(C=O)cc1
- Molecular Weight1
- 178.18
- CAS
- 50262-48-1
- Other Names
-
- 4-n-Propionyloxybenzaldehyde
- Benzaldehyde, 4-(1-oxopropoxy)-
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.5930 | Relay (... Calculated Property | |
| ΔfG° | -197.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -421.99 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 20.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.71 | kJ/mol | Relay (... Calculated Property |
| IE | 9.05 | eV | Relay (... Calculated Property |
| log10WS | -2.22 | Relay (... Calculated Property | |
| logPoct/wat | 1.814 | Crippen Calculated Property | |
| McVol | 137.010 | ml/mol | McGowan Calculated Property |
| Pc | 3295.37 | kPa | Joback Calculated Property |
| Tboil | 538.24 | K | Relay (... Calculated Property |
| Tc | 760.93 | K | Relay (... Calculated Property |
| Tfus | 334.27 | K | Relay (... Calculated Property |
| Vc | 0.498 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [316.66; 377.02] | J/mol×K | [584.81; 801.61] | 
|
| Cp,gas | 316.66 | J/mol×K | 584.81 | Joback Calculated Property |
| Cp,gas | 328.43 | J/mol×K | 620.94 | Joback Calculated Property |
| Cp,gas | 339.51 | J/mol×K | 657.08 | Joback Calculated Property |
| Cp,gas | 349.89 | J/mol×K | 693.21 | Joback Calculated Property |
| Cp,gas | 359.60 | J/mol×K | 729.34 | Joback Calculated Property |
| Cp,gas | 368.64 | J/mol×K | 765.48 | Joback Calculated Property |
| Cp,gas | 377.02 | J/mol×K | 801.61 | Joback Calculated Property |
| η | [0.0002484; 0.0017973] | Pa×s | [355.56; 584.81] |
|
| η | 0.0017973 | Pa×s | 355.56 | Joback Calculated Property |
| η | 0.0011012 | Pa×s | 393.77 | Joback Calculated Property |
| η | 0.0007358 | Pa×s | 431.98 | Joback Calculated Property |
| η | 0.0005249 | Pa×s | 470.18 | Joback Calculated Property |
| η | 0.0003940 | Pa×s | 508.39 | Joback Calculated Property |
| η | 0.0003078 | Pa×s | 546.60 | Joback Calculated Property |
| η | 0.0002484 | Pa×s | 584.81 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 406.50 ± 2.50 | K | 0.07 | NIST |
Similar Compounds
Find more compounds similar to p-Propionoxybenzaldehyde.
Sources
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