- InChI
- InChI=1S/C9H11ClO/c1-7-5-8(6-10)3-4-9(7)11-2/h3-5H,6H2,1-2H3
- InChI Key
- BHEHNICAPZVKRH-UHFFFAOYSA-N
- Formula
- C9H11ClO
- SMILES
- COc1ccc(CCl)cc1C
- Molecular Weight1
- 170.64
- CAS
- 60736-71-2
- 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° | 1.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -163.46 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.02 | kJ/mol | Joback Calculated Property |
| log10WS | -3.10 | Crippen Calculated Property | |
| logPoct/wat | 2.742 | Crippen Calculated Property | |
| McVol | 132.020 | ml/mol | McGowan Calculated Property |
| Pc | 2969.80 | kPa | Joback Calculated Property |
| Tboil | 501.81 | K | Joback Calculated Property |
| Tc | 716.06 | K | Joback Calculated Property |
| Tfus | 294.80 | K | Joback Calculated Property |
| Vc | 0.498 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [265.84; 330.52] | J/mol×K | [501.81; 716.06] | 
|
| Cp,gas | 265.84 | J/mol×K | 501.81 | Joback Calculated Property |
| Cp,gas | 278.07 | J/mol×K | 537.52 | Joback Calculated Property |
| Cp,gas | 289.71 | J/mol×K | 573.23 | Joback Calculated Property |
| Cp,gas | 300.76 | J/mol×K | 608.93 | Joback Calculated Property |
| Cp,gas | 311.25 | J/mol×K | 644.64 | Joback Calculated Property |
| Cp,gas | 321.16 | J/mol×K | 680.35 | Joback Calculated Property |
| Cp,gas | 330.52 | J/mol×K | 716.06 | Joback Calculated Property |
| η | [0.0002004; 0.0013866] | Pa×s | [294.80; 501.81] |
|
| η | 0.0013866 | Pa×s | 294.80 | Joback Calculated Property |
| η | 0.0008484 | Pa×s | 329.30 | Joback Calculated Property |
| η | 0.0005698 | Pa×s | 363.80 | Joback Calculated Property |
| η | 0.0004100 | Pa×s | 398.31 | Joback Calculated Property |
| η | 0.0003109 | Pa×s | 432.81 | Joback Calculated Property |
| η | 0.0002456 | Pa×s | 467.31 | Joback Calculated Property |
| η | 0.0002004 | Pa×s | 501.81 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Methoxy-3-methylbenzyl chloride.
Sources
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