- InChI
- InChI=1S/C10H13BrO/c1-10(2,3)8-6-7(11)4-5-9(8)12/h4-6,12H,1-3H3
- InChI Key
- IKMJSWBFODAWTC-UHFFFAOYSA-N
- Formula
- C10H13BrO
- SMILES
- CC(C)(C)c1cc(Br)ccc1O
- Molecular Weight1
- 229.11
- CAS
- 10323-39-4
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -1.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -184.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.95 | kJ/mol | Joback Calculated Property |
| log10WS | -3.50 | Crippen Calculated Property | |
| logPoct/wat | 3.452 | Crippen Calculated Property | |
| McVol | 151.370 | ml/mol | McGowan Calculated Property |
| Pc | 3786.98 | kPa | Joback Calculated Property |
| Tboil | 603.41 | K | Joback Calculated Property |
| Tc | 851.36 | K | Joback Calculated Property |
| Tfus | 415.34 | K | Joback Calculated Property |
| Vc | 0.504 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [351.39; 415.76] | J/mol×K | [603.41; 851.36] | 
|
| Cp,gas | 351.39 | J/mol×K | 603.41 | Joback Calculated Property |
| Cp,gas | 364.29 | J/mol×K | 644.73 | Joback Calculated Property |
| Cp,gas | 376.13 | J/mol×K | 686.06 | Joback Calculated Property |
| Cp,gas | 387.04 | J/mol×K | 727.38 | Joback Calculated Property |
| Cp,gas | 397.19 | J/mol×K | 768.71 | Joback Calculated Property |
| Cp,gas | 406.71 | J/mol×K | 810.03 | Joback Calculated Property |
| Cp,gas | 415.76 | J/mol×K | 851.36 | Joback Calculated Property |
| η | [0.0000350; 0.0008644] | Pa×s | [415.34; 603.41] |
|
| η | 0.0008644 | Pa×s | 415.34 | Joback Calculated Property |
| η | 0.0004200 | Pa×s | 446.69 | Joback Calculated Property |
| η | 0.0002243 | Pa×s | 478.03 | Joback Calculated Property |
| η | 0.0001294 | Pa×s | 509.38 | Joback Calculated Property |
| η | 0.0000796 | Pa×s | 540.72 | Joback Calculated Property |
| η | 0.0000516 | Pa×s | 572.06 | Joback Calculated Property |
| η | 0.0000350 | Pa×s | 603.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Bromo-2-t-butyl phenol.
Sources
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