- InChI
- InChI=1S/C5H6O2/c6-4-2-1-3-5-7/h1-2,4-5H,3H2/b2-1+
- InChI Key
- NEOPYIBVKJWHMN-OWOJBTEDSA-N
- Formula
- C5H6O2
- SMILES
- O=CC=CCC=O
- Molecular Weight1
- 98.10
- 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).
- 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° | -127.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -200.47 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.12 | kJ/mol | Joback Calculated Property |
| log10WS | -0.33 | Crippen Calculated Property | |
| logPoct/wat | 0.330 | Crippen Calculated Property | |
| McVol | 80.150 | ml/mol | McGowan Calculated Property |
| Pc | 4456.32 | kPa | Joback Calculated Property |
| I | [1969.00; 1969.00] |
|
|
| I | 1969.00 | NIST | |
| I | 1969.00 | NIST | |
| Tboil | 415.28 | K | Joback Calculated Property |
| Tc | 605.57 | K | Joback Calculated Property |
| Tfus | 225.03 | K | Joback Calculated Property |
| Vc | 0.330 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [144.63; 181.84] | J/mol×K | [415.28; 605.57] |
|
| Cp,gas | 144.63 | J/mol×K | 415.28 | Joback Calculated Property |
| Cp,gas | 151.76 | J/mol×K | 447.00 | Joback Calculated Property |
| Cp,gas | 158.49 | J/mol×K | 478.71 | Joback Calculated Property |
| Cp,gas | 164.85 | J/mol×K | 510.43 | Joback Calculated Property |
| Cp,gas | 170.85 | J/mol×K | 542.14 | Joback Calculated Property |
| Cp,gas | 176.50 | J/mol×K | 573.86 | Joback Calculated Property |
| Cp,gas | 181.84 | J/mol×K | 605.57 | Joback Calculated Property |
| η | [0.0003446; 0.0035287] | Pa×s | [225.03; 415.28] |
|
| η | 0.0035287 | Pa×s | 225.03 | Joback Calculated Property |
| η | 0.0018847 | Pa×s | 256.74 | Joback Calculated Property |
| η | 0.0011554 | Pa×s | 288.45 | Joback Calculated Property |
| η | 0.0007804 | Pa×s | 320.15 | Joback Calculated Property |
| η | 0.0005658 | Pa×s | 351.86 | Joback Calculated Property |
| η | 0.0004326 | Pa×s | 383.57 | Joback Calculated Property |
| η | 0.0003446 | Pa×s | 415.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-propen-1,3-dicarbaldehyde.
Sources
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