- InChI
- InChI=1S/C10H14O/c1-10(2,3)11-9-7-5-4-6-8-9/h4-8H,1-3H3
- InChI Key
- PNKZBZPLRKCVLI-UHFFFAOYSA-N
- Formula
- C10H14O
- SMILES
- CC(C)(C)Oc1ccccc1
- Molecular Weight1
- 150.22
- CAS
- 6669-13-2
- Other Names
-
- Ether, tert-butyl phenyl
- tert-Butoxybenzene
- tert-Butyl phenyl ether
- t-Butoxybenzene
- (1,1-Dimethylethoxy)benzene
- 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).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 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 |
|---|---|---|---|
| ΔfG° | 43.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -154.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.24 | kJ/mol | Joback Calculated Property |
| IE | [8.66; 8.77] | eV |
|
| IE | 8.77 | eV | NIST |
| IE | 8.66 | eV | NIST |
| IE | 8.75 | eV | NIST |
| log10WS | -2.96 | Crippen Calculated Property | |
| logPoct/wat | 2.864 | Crippen Calculated Property | |
| McVol | 133.870 | ml/mol | McGowan Calculated Property |
| Pc | 2937.70 | kPa | Joback Calculated Property |
| Inp | 1074.00 | NIST | |
| I | [1336.00; 1336.00] |
|
|
| I | 1336.00 | NIST | |
| I | 1336.00 | NIST | |
| Tboil | [465.15; 471.15] | K |
|
| Tboil | 471.15 ± 5.00 | K | NIST |
| Tboil | 465.15 ± 3.00 | K | NIST |
| Tc | 690.87 | K | Joback Calculated Property |
| Tfus | 254.84 ± 0.30 | K | NIST |
| Vc | 0.494 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [283.83; 366.04] | J/mol×K | [474.07; 690.87] |
|
| Cp,gas | 283.83 | J/mol×K | 474.07 | Joback Calculated Property |
| Cp,gas | 299.88 | J/mol×K | 510.20 | Joback Calculated Property |
| Cp,gas | 314.94 | J/mol×K | 546.34 | Joback Calculated Property |
| Cp,gas | 329.04 | J/mol×K | 582.47 | Joback Calculated Property |
| Cp,gas | 342.23 | J/mol×K | 618.60 | Joback Calculated Property |
| Cp,gas | 354.55 | J/mol×K | 654.73 | Joback Calculated Property |
| Cp,gas | 366.04 | J/mol×K | 690.87 | Joback Calculated Property |
| η | [0.0001940; 0.0039926] | Pa×s | [253.53; 474.07] |
|
| η | 0.0039926 | Pa×s | 253.53 | Joback Calculated Property |
| η | 0.0017530 | Pa×s | 290.29 | Joback Calculated Property |
| η | 0.0009261 | Pa×s | 327.04 | Joback Calculated Property |
| η | 0.0005566 | Pa×s | 363.80 | Joback Calculated Property |
| η | 0.0003673 | Pa×s | 400.56 | Joback Calculated Property |
| η | 0.0002599 | Pa×s | 437.31 | Joback Calculated Property |
| η | 0.0001940 | Pa×s | 474.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, (1,1-dimethylethoxy)-.
Sources
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