- InChI
- InChI=1S/C13H11BrO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9,13,15H
- InChI Key
- WTIWDBNPPSHSCB-UHFFFAOYSA-N
- Formula
- C13H11BrO
- SMILES
- OC(c1ccccc1)c1ccc(Br)cc1
- Molecular Weight1
- 263.13
- CAS
- 29334-16-5
- Other Names
-
- p-Bromobenzhydrol
- 4-Bromobenzhydrol
- Benzenemethanol, 4-bromo-«alpha»-phenyl-
- (4-Bromophenyl)phenylmethanol
- Phenyl-p-bromophenyl methanol
- p-bromobenzhydryl 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).
- 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 | 0.6207 | Relay (1.0) Calculated Property | |
| ΔfG° | 148.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 16.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.73 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.21 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.531 | Crippen Calculated Property | |
| McVol | 169.880 | ml/mol | McGowan Calculated Property |
| Pc | 3673.09 | kPa | Joback Calculated Property |
| Tboil | 576.35 | K | Relay (1.0) Calculated Property |
| Tc | 884.65 | K | Relay (1.0) Calculated Property |
| Tfus | 346.83 | K | Relay (1.0) Calculated Property |
| Vc | 0.602 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [412.17; 469.84] | J/mol×K | [713.08; 953.11] | 
|
| Cp,gas | 412.17 | J/mol×K | 713.08 | Joback Calculated Property |
| Cp,gas | 423.93 | J/mol×K | 753.08 | Joback Calculated Property |
| Cp,gas | 434.72 | J/mol×K | 793.09 | Joback Calculated Property |
| Cp,gas | 444.62 | J/mol×K | 833.09 | Joback Calculated Property |
| Cp,gas | 453.72 | J/mol×K | 873.10 | Joback Calculated Property |
| Cp,gas | 462.10 | J/mol×K | 913.10 | Joback Calculated Property |
| Cp,gas | 469.84 | J/mol×K | 953.11 | Joback Calculated Property |
| η | [0.0000418; 0.0018391] | Pa×s | [407.25; 713.08] |
|
| η | 0.0018391 | Pa×s | 407.25 | Joback Calculated Property |
| η | 0.0006894 | Pa×s | 458.22 | Joback Calculated Property |
| η | 0.0003145 | Pa×s | 509.19 | Joback Calculated Property |
| η | 0.0001655 | Pa×s | 560.16 | Joback Calculated Property |
| η | 0.0000970 | Pa×s | 611.14 | Joback Calculated Property |
| η | 0.0000617 | Pa×s | 662.11 | Joback Calculated Property |
| η | 0.0000418 | Pa×s | 713.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzhydrol, 4-bromo-.
Sources
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