- InChI
- InChI=1S/C8H10O/c1-7-3-2-4-8(5-7)6-9/h2-5,9H,6H2,1H3
- InChI Key
- JJCKHVUTVOPLBV-UHFFFAOYSA-N
- Formula
- C8H10O
- SMILES
- Cc1cccc(CO)c1
- Molecular Weight1
- 122.16
- CAS
- 587-03-1
- Other Names
-
- m-Tolyl carbinol
- m-Methyl benzyl alcohol
- Benzenemethanol, 3-methyl-
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.5885 | Relay (1.0) Calculated Property | |
| ΔfG° | -17.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -144.16 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.80 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.05 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.487 | Crippen Calculated Property | |
| McVol | 105.690 | ml/mol | McGowan Calculated Property |
| Pc | 4015.93 | kPa | Joback Calculated Property |
| Inp | [1104.20; 1104.20] |
|
|
| Inp | 1104.20 | NIST | |
| Inp | 1104.20 | NIST | |
| Tboil | 474.74 | K | Relay (1.0) Calculated Property |
| Tc | 722.09 | K | Relay (1.0) Calculated Property |
| Tfus | 255.88 | K | Relay (1.0) Calculated Property |
| Vc | 0.381 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [223.35; 277.48] | J/mol×K | [506.28; 704.92] |
|
| Cp,gas | 223.35 | J/mol×K | 506.28 | Joback Calculated Property |
| Cp,gas | 233.69 | J/mol×K | 539.39 | Joback Calculated Property |
| Cp,gas | 243.47 | J/mol×K | 572.49 | Joback Calculated Property |
| Cp,gas | 252.73 | J/mol×K | 605.60 | Joback Calculated Property |
| Cp,gas | 261.46 | J/mol×K | 638.71 | Joback Calculated Property |
| Cp,gas | 269.71 | J/mol×K | 671.81 | Joback Calculated Property |
| Cp,gas | 277.48 | J/mol×K | 704.92 | Joback Calculated Property |
| η | [0.0001373; 0.0114745] | Pa×s | [279.68; 506.28] |
|
| η | 0.0114745 | Pa×s | 279.68 | Joback Calculated Property |
| η | 0.0035387 | Pa×s | 317.45 | Joback Calculated Property |
| η | 0.0014015 | Pa×s | 355.21 | Joback Calculated Property |
| η | 0.0006632 | Pa×s | 392.98 | Joback Calculated Property |
| η | 0.0003578 | Pa×s | 430.75 | Joback Calculated Property |
| η | 0.0002133 | Pa×s | 468.51 | Joback Calculated Property |
| η | 0.0001373 | Pa×s | 506.28 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 488.20 | K | 98.70 | NIST |
Similar Compounds
Find more compounds similar to 3-Methylbenzyl alcohol.
Sources
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