- InChI
- InChI=1S/C8H9I/c1-6-3-4-8(9)5-7(6)2/h3-5H,1-2H3
- InChI Key
- CSFRCLYFVINMBZ-UHFFFAOYSA-N
- Formula
- C8H9I
- SMILES
- Cc1ccc(I)cc1C
- Molecular Weight1
- 232.06
- CAS
- 31599-61-8
- Other Names
-
- 1,2-Dimethyl-4-iodobenzene
- 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).
- 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 | 0.3375 | Relay (1.0) Calculated Property | |
| ΔfG° | 167.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 112.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.13 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.27 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.45 | 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 | 504.70 | K | NIST |
| Tc | 757.56 | K | Relay (1.0) Calculated Property |
| Tfus | 281.33 | K | Relay (1.0) Calculated Property |
| Vc | 0.443 | 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 |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 384.20 | K | 1.50 | NIST |
Similar Compounds
Find more compounds similar to Benzene, 4-iodo-1,2-dimethyl-.
Sources
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