- InChI
- InChI=1S/C10H10O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h2-7,12H,1H3/b3-2+
- InChI Key
- OCNIKEFATSKIBE-NSCUHMNNSA-N
- Formula
- C10H10O2
- SMILES
- CC(=O)C=Cc1ccc(O)cc1
- Molecular Weight1
- 162.19
- CAS
- 3160-35-8
- Other Names
-
- p-Hydroxybenzalacetone
- 4-(p-Hydroxyphenyl)-3-buten-2-one
- 4-Hydroxybenzylidene acetone
- 3-Buten-2-one, 4-(4-hydroxyphenyl)-
- p-Hydroxybenzylidene acetone
- 3-Buten-2-one, 4-(p-hydroxyphenyl)-
- 4-Hydroxybenzalacetone
- 4-(4-Hydroxyphenyl)-3-buten-2-one
- NSC 26516
- 4-(4-hydroxyphenyl)but-3-en-2-one
- 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° | -57.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -185.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.85 | kJ/mol | Joback Calculated Property |
| log10WS | -1.96 | Crippen Calculated Property | |
| logPoct/wat | 1.994 | Crippen Calculated Property | |
| McVol | 131.140 | ml/mol | McGowan Calculated Property |
| Pc | 3990.60 | kPa | Joback Calculated Property |
| Tboil | 593.53 | K | Joback Calculated Property |
| Tc | 830.21 | K | Joback Calculated Property |
| Tfus | 385.45 | K | Joback Calculated Property |
| Vc | 0.440 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [306.69; 365.00] | J/mol×K | [593.53; 830.21] | 
|
| Cp,gas | 306.69 | J/mol×K | 593.53 | Joback Calculated Property |
| Cp,gas | 318.32 | J/mol×K | 632.98 | Joback Calculated Property |
| Cp,gas | 329.04 | J/mol×K | 672.42 | Joback Calculated Property |
| Cp,gas | 338.95 | J/mol×K | 711.87 | Joback Calculated Property |
| Cp,gas | 348.17 | J/mol×K | 751.32 | Joback Calculated Property |
| Cp,gas | 356.82 | J/mol×K | 790.76 | Joback Calculated Property |
| Cp,gas | 365.00 | J/mol×K | 830.21 | Joback Calculated Property |
| η | [0.0000375; 0.0014544] | Pa×s | [385.45; 593.53] |
|
| η | 0.0014544 | Pa×s | 385.45 | Joback Calculated Property |
| η | 0.0006148 | Pa×s | 420.13 | Joback Calculated Property |
| η | 0.0002964 | Pa×s | 454.81 | Joback Calculated Property |
| η | 0.0001584 | Pa×s | 489.49 | Joback Calculated Property |
| η | 0.0000920 | Pa×s | 524.17 | Joback Calculated Property |
| η | 0.0000572 | Pa×s | 558.85 | Joback Calculated Property |
| η | 0.0000375 | Pa×s | 593.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-(4-Hydroxybenzylidene)acetone.
Sources
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