- InChI
- InChI=1S/C8H10O/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3/t7-/m1/s1
- InChI Key
- WAPNOHKVXSQRPX-SSDOTTSWSA-N
- Formula
- C8H10O
- SMILES
- CC(O)c1ccccc1
- Molecular Weight1
- 122.16
- CAS
- 1445-91-6
- Other Names
-
- (R)-(+)-1-phenylethanol
- Benzenemethanol, «alpha»-methyl-, («alpha»S)-
- Benzenemethanol, «alpha»-methyl-, («alpha»S)-
- ω : Acentric Factor.
- 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).
- 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).
- ρl : Liquid Density (kg/m3).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 | 0.5342 | Relay (1.0) Calculated Property | |
| ΔfG° | -10.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -167.29 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.17 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.09 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.740 | Crippen Calculated Property | |
| McVol | 105.690 | ml/mol | McGowan Calculated Property |
| Pc | 4135.61 | kPa | Joback Calculated Property |
| Tboil | 453.79 | K | Relay (1.0) Calculated Property |
| Tc | 688.68 | K | Relay (1.0) Calculated Property |
| Tfus | 286.10 | K | Relay (1.0) Calculated Property |
| Vc | 0.386 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [223.82; 280.74] | J/mol×K | [500.86; 702.73] | 
|
| Cp,gas | 223.82 | J/mol×K | 500.86 | Joback Calculated Property |
| Cp,gas | 234.83 | J/mol×K | 534.50 | Joback Calculated Property |
| Cp,gas | 245.20 | J/mol×K | 568.15 | Joback Calculated Property |
| Cp,gas | 254.95 | J/mol×K | 601.79 | Joback Calculated Property |
| Cp,gas | 264.10 | J/mol×K | 635.44 | Joback Calculated Property |
| Cp,gas | 272.69 | J/mol×K | 669.08 | Joback Calculated Property |
| Cp,gas | 280.74 | J/mol×K | 702.73 | Joback Calculated Property |
| η | [0.0001385; 0.0382650] | Pa×s | [252.16; 500.86] |
|
| η | 0.0382650 | Pa×s | 252.16 | Joback Calculated Property |
| η | 0.0077399 | Pa×s | 293.61 | Joback Calculated Property |
| η | 0.0023249 | Pa×s | 335.06 | Joback Calculated Property |
| η | 0.0009101 | Pa×s | 376.51 | Joback Calculated Property |
| η | 0.0004291 | Pa×s | 417.96 | Joback Calculated Property |
| η | 0.0002317 | Pa×s | 459.41 | Joback Calculated Property |
| η | 0.0001385 | Pa×s | 500.86 | Joback Calculated Property |
| ρl | 1012.40 | kg/m3 | 298.15 | Enthalpic changes on mixing two couples of S- and R-enantiomers of benzyl-(1-phenyl-ethyl)-amine, 1-phenylethylamine, 1-phenyl-ethanol, butyric acid oxiranylmethyl ester, 4-methyl-[1,3]dioxolan-2-one, 2-chloro-methyloxirane and 3-hydroxyisobutyric acid methyl ester at T = 298.15 K |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 371.20 | K | 2.70 | NIST |
Similar Compounds
Find more compounds similar to Benzenemethanol, «alpha»-methyl-, (S)-.
Mixtures
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Enthalpic changes on mixing two couples of S- and R-enantiomers of benzyl-(1-phenyl-ethyl)-amine, 1-phenylethylamine, 1-phenyl-ethanol, butyric acid oxiranylmethyl ester, 4-methyl-[1,3]dioxolan-2-one, 2-chloro-methyloxirane and 3-hydroxyisobutyric acid methyl ester at T = 298.15 K
- Joback Method
- McGowan Method
- NIST Webbook
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