- InChI
- InChI=1S/C10H12O/c1-9(8-11)7-10-5-3-2-4-6-10/h2-7,11H,8H2,1H3/b9-7-
- InChI Key
- LLNAMUJRIZIXHF-CLFYSBASSA-N
- Formula
- C10H12O
- SMILES
- CC(=Cc1ccccc1)CO
- Molecular Weight1
- 148.20
- CAS
- 1504-55-8
- Other Names
-
- 2-Propen-1-ol, 2-methyl-3-phenyl-
- Cinnamyl alcohol, «alpha»-methyl-
- Methyl cinnamic alcohol
- «alpha»-Methylcinnamyl alcohol
- 3-Phenyl-2-methyl-propen-2-ol-1
- 1-Phenyl-2-methylprop-1-ene-3-ol
- «alpha»-Methylcinnamic alcohol
- «beta»-methylcinnamyl alcohol
- 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.
- 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 |
|---|---|---|---|
| ω | 0.5833 | Relay (1.0) Calculated Property | |
| ΔfG° | 80.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -73.57 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 18.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.77 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.38 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.76 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.082 | Crippen Calculated Property | |
| McVol | 129.570 | ml/mol | McGowan Calculated Property |
| Pc | 3468.36 | kPa | Joback Calculated Property |
| Inp | [1343.00; 1343.00] |
|
|
| Inp | 1343.00 | NIST | |
| Inp | 1343.00 | NIST | |
| I | [2252.00; 2252.00] |
|
|
| I | 2252.00 | NIST | |
| I | 2252.00 | NIST | |
| Tboil | 534.53 | K | Relay (1.0) Calculated Property |
| Tc | 751.84 | K | Relay (1.0) Calculated Property |
| Tfus | 297.98 | K | Relay (1.0) Calculated Property |
| Vc | 0.450 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [292.52; 354.73] | J/mol×K | [551.10; 755.46] |
|
| Cp,gas | 292.52 | J/mol×K | 551.10 | Joback Calculated Property |
| Cp,gas | 304.65 | J/mol×K | 585.16 | Joback Calculated Property |
| Cp,gas | 316.02 | J/mol×K | 619.22 | Joback Calculated Property |
| Cp,gas | 326.66 | J/mol×K | 653.28 | Joback Calculated Property |
| Cp,gas | 336.63 | J/mol×K | 687.34 | Joback Calculated Property |
| Cp,gas | 345.97 | J/mol×K | 721.40 | Joback Calculated Property |
| Cp,gas | 354.73 | J/mol×K | 755.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methyl-3-phenyl-2-propen-1-ol.
Sources
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