- InChI
- InChI=1S/C15H16O2/c1-15(2,11-7-9-12(16)10-8-11)13-5-3-4-6-14(13)17/h3-10,16-17H,1-2H3
- InChI Key
- MLCQXUZZAXKTSG-UHFFFAOYSA-N
- Formula
- C15H16O2
- SMILES
- CC(C)(c1ccc(O)cc1)c1ccccc1O
- Molecular Weight1
- 228.29
- CAS
- 837-08-1
- Other Names
-
- 2,4'-Bisphenol A
- Phenol, 2-[1-(4-hydroxyphenyl)-1-methylethyl]-
- 2,4'-Dihydroxydiphenyldimethylmethane
- 2,4'-Isopropylidenediphenol
- 2-(4'-Hydroxyphenyl)-2-(2'-hydroxyphenyl)propane
- o-[1-(4-hydroxyphenyl)-1-methylethyl]phenol
- 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 | 0.6921 | Relay (1.0) Calculated Property | |
| ΔfG° | -6.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -195.29 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.84 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 112.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.89 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.30 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.424 | Crippen Calculated Property | |
| McVol | 186.430 | ml/mol | McGowan Calculated Property |
| Pc | 3547.31 | kPa | Joback Calculated Property |
| Tboil | 595.53 | K | Relay (1.0) Calculated Property |
| Tc | 904.53 | K | Relay (1.0) Calculated Property |
| Tfus | 372.42 | K | Relay (1.0) Calculated Property |
| Vc | 0.638 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [528.97; 608.03] | J/mol×K | [753.97; 1018.62] | 
|
| Cp,gas | 528.97 | J/mol×K | 753.97 | Joback Calculated Property |
| Cp,gas | 543.20 | J/mol×K | 798.08 | Joback Calculated Property |
| Cp,gas | 556.63 | J/mol×K | 842.19 | Joback Calculated Property |
| Cp,gas | 569.54 | J/mol×K | 886.29 | Joback Calculated Property |
| Cp,gas | 582.22 | J/mol×K | 930.40 | Joback Calculated Property |
| Cp,gas | 594.96 | J/mol×K | 974.51 | Joback Calculated Property |
| Cp,gas | 608.03 | J/mol×K | 1018.62 | Joback Calculated Property |
| η | [0.0000007; 0.0000313] | Pa×s | [537.51; 753.97] |
|
| η | 0.0000313 | Pa×s | 537.51 | Joback Calculated Property |
| η | 0.0000137 | Pa×s | 573.59 | Joback Calculated Property |
| η | 0.0000066 | Pa×s | 609.66 | Joback Calculated Property |
| η | 0.0000035 | Pa×s | 645.74 | Joback Calculated Property |
| η | 0.0000019 | Pa×s | 681.82 | Joback Calculated Property |
| η | 0.0000012 | Pa×s | 717.89 | Joback Calculated Property |
| η | 0.0000007 | Pa×s | 753.97 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 2,4'-isopropylidenedi-.
Sources
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