- InChI
- InChI=1S/C7H7ClO/c8-7-4-2-1-3-6(7)5-9/h1-4,9H,5H2
- InChI Key
- MBYQPPXEXWRMQC-UHFFFAOYSA-N
- Formula
- C7H7ClO
- SMILES
- OCc1ccccc1Cl
- Molecular Weight1
- 142.58
- CAS
- 17849-38-6
- Other Names
-
- Benzyl alcohol, o-chloro-
- o-Chlorobenzyl alcohol
- 2-Chlorobenzyl alcohol
- ortho-Chlorobenzyl alcohol
- (2-Chloro-phenyl)-methanol
- 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 | 0.5634 | Relay (1.0) Calculated Property | |
| ΔfG° | -37.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -147.51 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 15.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.73 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.90 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.38 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.832 | Crippen Calculated Property | |
| McVol | 103.840 | ml/mol | McGowan Calculated Property |
| Pc | 4333.96 | kPa | Joback Calculated Property |
| Tboil | [500.20; 503.20] | K |
|
| Tboil | 500.20 | K | NIST |
| Tboil | 503.20 | K | NIST |
| Tc | 763.15 | K | Relay (1.0) Calculated Property |
| Tfus | 302.95 | K | Relay (1.0) Calculated Property |
| Vc | 0.367 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [204.63; 249.01] | J/mol×K | [520.83; 727.48] |
|
| Cp,gas | 204.63 | J/mol×K | 520.83 | Joback Calculated Property |
| Cp,gas | 213.25 | J/mol×K | 555.27 | Joback Calculated Property |
| Cp,gas | 221.36 | J/mol×K | 589.71 | Joback Calculated Property |
| Cp,gas | 228.96 | J/mol×K | 624.16 | Joback Calculated Property |
| Cp,gas | 236.09 | J/mol×K | 658.60 | Joback Calculated Property |
| Cp,gas | 242.77 | J/mol×K | 693.04 | Joback Calculated Property |
| Cp,gas | 249.01 | J/mol×K | 727.48 | Joback Calculated Property |
| η | [0.0001451; 0.0085009] | Pa×s | [298.33; 520.83] |
|
| η | 0.0085009 | Pa×s | 298.33 | Joback Calculated Property |
| η | 0.0029645 | Pa×s | 335.41 | Joback Calculated Property |
| η | 0.0012750 | Pa×s | 372.50 | Joback Calculated Property |
| η | 0.0006389 | Pa×s | 409.58 | Joback Calculated Property |
| η | 0.0003591 | Pa×s | 446.66 | Joback Calculated Property |
| η | 0.0002205 | Pa×s | 483.75 | Joback Calculated Property |
| η | 0.0001451 | Pa×s | 520.83 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 375.70 | K | 3.70 | NIST |
Similar Compounds
Find more compounds similar to Benzenemethanol, 2-chloro-.
Sources
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