- InChI
- InChI=1S/C4H8O2/c1-4(6)2-3-5/h3-4,6H,2H2,1H3
- InChI Key
- HSJKGGMUJITCBW-UHFFFAOYSA-N
- Formula
- C4H8O2
- SMILES
- CC(O)CC=O
- Molecular Weight1
- 88.11
- CAS
- 107-89-1
- Other Names
-
- Butyraldehyde, 3-hydroxy-
- «beta»-Hydroxybutyraldehyde
- Acetaldol
- Aldol
- 3-Butanolal
- 3-Hydroxybutyraldehyde
- Oxybutanal
- Oxybutyric aldehyde
- 3-Hydroxybutanal
- UN 2839
- beta-Hydroxybutyraldehyde
- NSC 7610
- 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).
- 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° | -255.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -368.98 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.51 | kJ/mol | Joback Calculated Property |
| log10WS | -0.15 | Crippen Calculated Property | |
| logPoct/wat | -0.044 | Crippen Calculated Property | |
| McVol | 74.660 | ml/mol | McGowan Calculated Property |
| Pc | 4903.92 | kPa | Joback Calculated Property |
| Tboil | 431.32 | K | Joback Calculated Property |
| Tc | 604.34 | K | Joback Calculated Property |
| Tfus | 222.66 | K | Joback Calculated Property |
| Vc | 0.289 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [148.52; 184.05] | J/mol×K | [431.32; 604.34] | 
|
| Cp,gas | 148.52 | J/mol×K | 431.32 | Joback Calculated Property |
| Cp,gas | 155.08 | J/mol×K | 460.16 | Joback Calculated Property |
| Cp,gas | 161.39 | J/mol×K | 488.99 | Joback Calculated Property |
| Cp,gas | 167.43 | J/mol×K | 517.83 | Joback Calculated Property |
| Cp,gas | 173.21 | J/mol×K | 546.67 | Joback Calculated Property |
| Cp,gas | 178.75 | J/mol×K | 575.51 | Joback Calculated Property |
| Cp,gas | 184.05 | J/mol×K | 604.34 | Joback Calculated Property |
| η | [0.0003004; 0.0924811] | Pa×s | [222.66; 431.32] |
|
| η | 0.0924811 | Pa×s | 222.66 | Joback Calculated Property |
| η | 0.0186726 | Pa×s | 257.44 | Joback Calculated Property |
| η | 0.0055176 | Pa×s | 292.21 | Joback Calculated Property |
| η | 0.0021130 | Pa×s | 326.99 | Joback Calculated Property |
| η | 0.0009732 | Pa×s | 361.77 | Joback Calculated Property |
| η | 0.0005135 | Pa×s | 396.54 | Joback Calculated Property |
| η | 0.0003004 | Pa×s | 431.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Butanal, 3-hydroxy-.
Sources
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