- InChI
- InChI=1S/C9H11Br/c1-6-4-8(3)9(10)5-7(6)2/h4-5H,1-3H3
- InChI Key
- SCZXFZRJDVZMJI-UHFFFAOYSA-N
- Formula
- C9H11Br
- SMILES
- Cc1cc(C)c(Br)cc1C
- Molecular Weight1
- 199.09
- CAS
- 5469-19-2
- Other Names
-
- 5-Bromopseudocumene
- 2,4,5-Trimethylbromobenzene
- 5-Bromo-1,2,4-trimethylbenzene
- 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° | 122.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -0.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.33 | kJ/mol | Joback Calculated Property |
| log10WS | -4.06 | Crippen Calculated Property | |
| logPoct/wat | 3.374 | Crippen Calculated Property | |
| McVol | 131.410 | ml/mol | McGowan Calculated Property |
| Pc | 3352.86 | kPa | Joback Calculated Property |
| Tboil | 507.20 | K | NIST |
| Tc | 741.49 | K | Joback Calculated Property |
| Tfus | 314.97 | K | Joback Calculated Property |
| Vc | 0.493 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [254.32; 317.20] | J/mol×K | [513.10; 741.49] | 
|
| Cp,gas | 254.32 | J/mol×K | 513.10 | Joback Calculated Property |
| Cp,gas | 266.40 | J/mol×K | 551.16 | Joback Calculated Property |
| Cp,gas | 277.81 | J/mol×K | 589.23 | Joback Calculated Property |
| Cp,gas | 288.57 | J/mol×K | 627.29 | Joback Calculated Property |
| Cp,gas | 298.70 | J/mol×K | 665.36 | Joback Calculated Property |
| Cp,gas | 308.23 | J/mol×K | 703.42 | Joback Calculated Property |
| Cp,gas | 317.20 | J/mol×K | 741.49 | Joback Calculated Property |
| η | [0.0002530; 0.0012798] | Pa×s | [314.97; 513.10] |
|
| η | 0.0012798 | Pa×s | 314.97 | Joback Calculated Property |
| η | 0.0008593 | Pa×s | 347.99 | Joback Calculated Property |
| η | 0.0006182 | Pa×s | 381.01 | Joback Calculated Property |
| η | 0.0004687 | Pa×s | 414.04 | Joback Calculated Property |
| η | 0.0003702 | Pa×s | 447.06 | Joback Calculated Property |
| η | 0.0003021 | Pa×s | 480.08 | Joback Calculated Property |
| η | 0.0002530 | Pa×s | 513.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1-bromo-2,4,5-trimethyl-.
Sources
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