- InChI
- InChI=1S/C8H9I/c1-6-4-3-5-7(2)8(6)9/h3-5H,1-2H3
- InChI Key
- QTUGGVBKWIYQSS-UHFFFAOYSA-N
- Formula
- C8H9I
- SMILES
- Cc1cccc(C)c1I
- Molecular Weight1
- 232.06
- Other Names
-
- 1,3-dimethyl-2-iodobenzene
- 1-iodo-2,6-dimethylbenzene
- 2,6-Dimethyliodobenzene
- 2-iodo-1,3-dimethylbenzene
- 2-iodo-m-xylene
- benzene, 1-iodo-2,6-dimethyl-
- m-xylene, 2-iodo-
- 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).
- Pvap : Vapor 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 | 0.3153 | Relay (1.0) Calculated Property | |
| ΔfG° | 167.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 116.67 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.37 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.42 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.21 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.908 | Crippen Calculated Property | |
| McVol | 125.640 | ml/mol | McGowan Calculated Property |
| Pc | 3431.89 | kPa | Joback Calculated Property |
| Tboil | 502.70 | K | NIST |
| Tc | 739.72 | K | Relay (1.0) Calculated Property |
| Tfus | 284.33 ± 0.30 | K | NIST |
| Vc | 0.439 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [223.00; 280.64] | J/mol×K | [512.42; 762.07] | 
|
| Cp,gas | 223.00 | J/mol×K | 512.42 | Joback Calculated Property |
| Cp,gas | 234.41 | J/mol×K | 554.03 | Joback Calculated Property |
| Cp,gas | 245.04 | J/mol×K | 595.64 | Joback Calculated Property |
| Cp,gas | 254.93 | J/mol×K | 637.24 | Joback Calculated Property |
| Cp,gas | 264.13 | J/mol×K | 678.85 | Joback Calculated Property |
| Cp,gas | 272.69 | J/mol×K | 720.46 | Joback Calculated Property |
| Cp,gas | 280.64 | J/mol×K | 762.07 | Joback Calculated Property |
| η | [0.0002881; 0.0021926] | Pa×s | [289.44; 512.42] |
|
| η | 0.0021926 | Pa×s | 289.44 | Joback Calculated Property |
| η | 0.0012896 | Pa×s | 326.60 | Joback Calculated Property |
| η | 0.0008454 | Pa×s | 363.77 | Joback Calculated Property |
| η | 0.0005993 | Pa×s | 400.93 | Joback Calculated Property |
| η | 0.0004504 | Pa×s | 438.09 | Joback Calculated Property |
| η | 0.0003540 | Pa×s | 475.26 | Joback Calculated Property |
| η | 0.0002881 | Pa×s | 512.42 | Joback Calculated Property |
| Pvap | [5.00e-03; 0.17] | kPa | [284.50; 333.40] |
|
| Pvap | 5.00e-03 | kPa | 284.50 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 7.09e-03 | kPa | 288.40 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 9.25e-03 | kPa | 291.60 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.01 | kPa | 296.50 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.02 | kPa | 298.40 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.02 | kPa | 299.50 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.02 | kPa | 301.50 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.02 | kPa | 303.30 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.03 | kPa | 306.40 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.03 | kPa | 308.30 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.04 | kPa | 311.40 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.05 | kPa | 313.60 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.06 | kPa | 316.40 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.07 | kPa | 318.40 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.08 | kPa | 321.20 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.09 | kPa | 323.40 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.11 | kPa | 326.30 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.13 | kPa | 328.50 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.15 | kPa | 331.30 | Thermochemistry of Halogen-Substituted Methylbenzenes |
| Pvap | 0.17 | kPa | 333.40 | Thermochemistry of Halogen-Substituted Methylbenzenes |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 375.70 | K | 1.90 | NIST |
Similar Compounds
Find more compounds similar to Benzene, 2-iodo-1,3-dimethyl-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Thermochemistry of Halogen-Substituted Methylbenzenes
- Joback Method
- McGowan Method
- NIST Webbook
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