- InChI
- InChI=1S/C3H6O/c1-3(2)4/h4H,1H2,2H3
- InChI Key
- NARVIWMVBMUEOG-UHFFFAOYSA-N
- Formula
- C3H6O
- SMILES
- C=C(C)O
- Molecular Weight1
- 58.08
- CAS
- 74324-85-9
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.5250 | Relay (1.0) Calculated Property | |
| ΔfG° | -83.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -171.62 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 5.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.20 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.12 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.078 | Crippen Calculated Property | |
| McVol | 54.700 | ml/mol | McGowan Calculated Property |
| Pc | 5351.35 | kPa | Joback Calculated Property |
| Inp | 534.00 | NIST | |
| Tboil | 380.20 | K | Relay (1.0) Calculated Property |
| Tc | 528.83 | K | Relay (1.0) Calculated Property |
| Tfus | 258.46 | K | Relay (1.0) Calculated Property |
| Vc | 0.195 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [88.38; 115.76] | J/mol×K | [356.78; 525.49] | 
|
| Cp,gas | 88.38 | J/mol×K | 356.78 | Joback Calculated Property |
| Cp,gas | 93.45 | J/mol×K | 384.90 | Joback Calculated Property |
| Cp,gas | 98.30 | J/mol×K | 413.02 | Joback Calculated Property |
| Cp,gas | 102.96 | J/mol×K | 441.14 | Joback Calculated Property |
| Cp,gas | 107.41 | J/mol×K | 469.26 | Joback Calculated Property |
| Cp,gas | 111.68 | J/mol×K | 497.37 | Joback Calculated Property |
| Cp,gas | 115.76 | J/mol×K | 525.49 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propen-2-ol.
Sources
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