- InChI
- InChI=1S/C13H10O2/c14-12-9-5-4-8-11(12)13(15)10-6-2-1-3-7-10/h1-9,14H
- InChI Key
- HJIAMFHSAAEUKR-UHFFFAOYSA-N
- Formula
- C13H10O2
- SMILES
- O=C(c1ccccc1)c1ccccc1O
- Molecular Weight1
- 198.22
- Other Names
-
- (2-Hydroxyphenyl)phenylmethanone
- 2-Hydroxybenzophenone
- Benzophenone, 2-hydroxy-
- NSC 623
- Phenyl 2-hydroxyphenyl ketone
- o-Benzoylphenol
- o-Hydroxybenzophenone
- ortho-Hydroxybenzophenone
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (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 | 0.6417 | Relay (1.0) Calculated Property | |
| ΔfG° | -0.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -150.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 24.89 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.40 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.95 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.623 | Crippen Calculated Property | |
| McVol | 153.950 | ml/mol | McGowan Calculated Property |
| Pc | 3945.61 | kPa | Joback Calculated Property |
| Tboil | 588.14 | K | Relay (1.0) Calculated Property |
| Tc | 890.87 | K | Relay (1.0) Calculated Property |
| Tfus | [308.00; 312.65] | K |
|
| Tfus | 312.65 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Tfus | 308.00 ± 3.00 | K | NIST |
| Vc | 0.545 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔfusH | 0.67 | kJ/mol | 308.20 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [445.20; 523.20] | K | [1.60; 74.70] |
|
| Tboilr | 445.20 | K | 1.60 | NIST |
| Tboilr | 523.20 | K | 74.70 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [184.56; 464.40] | 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 | -7.83000e+01 | |||
| Coefficient B | 1.20760e+00 | |||
| Coefficient C | -9.83460e-04 | |||
| Coefficient D | 3.18560e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 184.56 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 239.94 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 286.90 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 326.44 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 359.57 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 387.31 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 410.65 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 430.61 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 448.19 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 464.40 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0447006; 0.0000257] | Pa×s | [310.32; 661.72] |
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 | -1.71586e+01 | |||
| Coefficient B | 4.36033e+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. | 310.32 | |||
| Temperature range, max. | 661.72 | |||
| η | 0.0447006 | Pa×s | 310.32 | Calculated Property |
| η | 0.0092974 | Pa×s | 349.37 | Calculated Property |
| η | 0.0026516 | Pa×s | 388.41 | Calculated Property |
| η | 0.0009510 | Pa×s | 427.46 | Calculated Property |
| η | 0.0004050 | Pa×s | 466.50 | Calculated Property |
| η | 0.0001967 | Pa×s | 505.54 | Calculated Property |
| η | 0.0001060 | Pa×s | 544.59 | Calculated Property |
| η | 0.0000620 | Pa×s | 583.63 | Calculated Property |
| η | 0.0000388 | Pa×s | 622.67 | Calculated Property |
| η | 0.0000257 | Pa×s | 661.72 | Calculated Property |
Similar Compounds
Find more compounds similar to Methanone, (2-hydroxyphenyl)phenyl-.
Sources
- Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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