- InChI
- InChI=1S/C10H14O/c11-9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2
- InChI Key
- LDZLXQFDGRCELX-UHFFFAOYSA-N
- Formula
- C10H14O
- SMILES
- OCCCCc1ccccc1
- Molecular Weight1
- 150.22
- Other Names
-
- 1-butanol, 4-phenyl-
- 4-Phenyl butanol-1
- 4-Phenyl-n-butanol
- 4-Phenylbutanol
- 4-phenyl-1-butanol
- 4-phenylbutan-1-ol
- Phenylbutyl alcohol
- 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).
- 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 | 0.6853 | Relay (1.0) Calculated Property | |
| ΔfG° | 8.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -159.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.01 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.81 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.70 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.002 | Crippen Calculated Property | |
| McVol | 133.870 | ml/mol | McGowan Calculated Property |
| Pc | 3070.00 | kPa | Vapor-Liquid Critical Properties of Phenol and (C8 to C10) Phenylalkanols |
| Tboil | 539.60 | K | Relay (1.0) Calculated Property |
| Tc | 756.94 | K | Relay (1.0) Calculated Property |
| Tfus | 255.80 | K | Relay (1.0) Calculated Property |
| Vc | 0.481 | m3/kmol | Relay (1.0) Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 413.20 | K | 1.90 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [172.86; 435.38] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -3.48160e+01 | |||
| Coefficient B | 9.08900e-01 | |||
| Coefficient C | -5.81800e-04 | |||
| Coefficient D | 1.43100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 172.86 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 220.25 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 262.03 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 298.65 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 330.56 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 358.22 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 382.08 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 402.59 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 420.21 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 435.38 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0140109; 0.0001452] | Pa×s | [289.70; 517.82] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.46409e+01 | |||
| Coefficient B | 3.00505e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 289.70 | |||
| Temperature range, max. | 517.82 | |||
| η | 0.0140109 | Pa×s | 289.70 | Calculated Property |
| η | 0.0060818 | Pa×s | 315.05 | Calculated Property |
| η | 0.0029893 | Pa×s | 340.39 | Calculated Property |
| η | 0.0016213 | Pa×s | 365.74 | Calculated Property |
| η | 0.0009519 | Pa×s | 391.09 | Calculated Property |
| η | 0.0005963 | Pa×s | 416.43 | Calculated Property |
| η | 0.0003942 | Pa×s | 441.78 | Calculated Property |
| η | 0.0002725 | Pa×s | 467.13 | Calculated Property |
| η | 0.0001957 | Pa×s | 492.47 | Calculated Property |
| η | 0.0001452 | Pa×s | 517.82 | Calculated Property |
Similar Compounds
Find more compounds similar to BENZENEBUTANOL.
Mixtures
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Vapor-Liquid Critical Properties of Phenol and (C8 to C10) Phenylalkanols
- Partitioning of Phenylalkanols between Micelles and Water Studied by Limiting Interdiffusion Coefficients in Water and Tetradecyltrimethylammonium Bromide Solutions
- Joback Method
- McGowan Method
- NIST Webbook
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