- InChI
- InChI=1S/C10H13Cl/c1-8(2)10-5-3-9(7-11)4-6-10/h3-6,8H,7H2,1-2H3
- InChI Key
- CYAKWEQUWJAHLW-UHFFFAOYSA-N
- Formula
- C10H13Cl
- SMILES
- CC(C)c1ccc(CCl)cc1
- Molecular Weight1
- 168.66
- CAS
- 2051-18-5
- Other Names
-
- p-Isopropylbenzyl chloride
- Benzene, 1-(chloromethyl)-4-(1-methylethyl)-
- p-Cymene, 7-chloro-
- Benzene, 1-(chloromethyl)-4-(methylethyl)-
- 4-Isopropylbenzyl chloride
- 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).
- Inp : Non-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° | 121.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -45.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.79 | kJ/mol | Joback Calculated Property |
| log10WS | -3.69 | Crippen Calculated Property | |
| logPoct/wat | 3.549 | Crippen Calculated Property | |
| McVol | 140.240 | ml/mol | McGowan Calculated Property |
| Pc | 2796.51 | kPa | Joback Calculated Property |
| Inp | 1252.00 | NIST | |
| Tboil | 496.85 | K | Joback Calculated Property |
| Tc | 713.53 | K | Joback Calculated Property |
| Tfus | 256.32 | K | Joback Calculated Property |
| Vc | 0.530 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [285.81; 360.16] | J/mol×K | [496.85; 713.53] | 
|
| Cp,gas | 285.81 | J/mol×K | 496.85 | Joback Calculated Property |
| Cp,gas | 300.18 | J/mol×K | 532.96 | Joback Calculated Property |
| Cp,gas | 313.72 | J/mol×K | 569.08 | Joback Calculated Property |
| Cp,gas | 326.45 | J/mol×K | 605.19 | Joback Calculated Property |
| Cp,gas | 338.41 | J/mol×K | 641.30 | Joback Calculated Property |
| Cp,gas | 349.64 | J/mol×K | 677.42 | Joback Calculated Property |
| Cp,gas | 360.16 | J/mol×K | 713.53 | Joback Calculated Property |
| η | [0.0002211; 0.0033760] | Pa×s | [256.32; 496.85] |
|
| η | 0.0033760 | Pa×s | 256.32 | Joback Calculated Property |
| η | 0.0015764 | Pa×s | 296.41 | Joback Calculated Property |
| η | 0.0008825 | Pa×s | 336.50 | Joback Calculated Property |
| η | 0.0005590 | Pa×s | 376.58 | Joback Calculated Property |
| η | 0.0003866 | Pa×s | 416.67 | Joback Calculated Property |
| η | 0.0002853 | Pa×s | 456.76 | Joback Calculated Property |
| η | 0.0002211 | Pa×s | 496.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 7-Chloro-p-cymene.
Sources
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