- InChI
- InChI=1S/C12H18O2/c1-3-4-9-14-10-11-7-5-6-8-12(11)13-2/h5-8H,3-4,9-10H2,1-2H3
- InChI Key
- VXUZNNBKVUZVJM-UHFFFAOYSA-N
- Formula
- C12H18O2
- SMILES
- CCCCOCc1ccccc1OC
- Molecular Weight1
- 194.27
- 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).
- 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 | 0.5925 | Relay (1.0) Calculated Property | |
| ΔfG° | -57.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -311.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.86 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.27 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.50 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.012 | Crippen Calculated Property | |
| McVol | 167.920 | ml/mol | McGowan Calculated Property |
| Pc | 2293.71 | kPa | Joback Calculated Property |
| Inp | 1481.00 | NIST | |
| Tboil | 519.70 | K | Relay (1.0) Calculated Property |
| Tc | 727.92 | K | Relay (1.0) Calculated Property |
| Tfus | 240.94 | K | Relay (1.0) Calculated Property |
| Vc | 0.615 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [398.56; 482.54] | J/mol×K | [550.46; 747.58] | 
|
| Cp,gas | 398.56 | J/mol×K | 550.46 | Joback Calculated Property |
| Cp,gas | 414.33 | J/mol×K | 583.31 | Joback Calculated Property |
| Cp,gas | 429.38 | J/mol×K | 616.17 | Joback Calculated Property |
| Cp,gas | 443.72 | J/mol×K | 649.02 | Joback Calculated Property |
| Cp,gas | 457.36 | J/mol×K | 681.87 | Joback Calculated Property |
| Cp,gas | 470.30 | J/mol×K | 714.73 | Joback Calculated Property |
| Cp,gas | 482.54 | J/mol×K | 747.58 | Joback Calculated Property |
| η | [0.0001371; 0.0014761] | Pa×s | [308.40; 550.46] |
|
| η | 0.0014761 | Pa×s | 308.40 | Joback Calculated Property |
| η | 0.0007899 | Pa×s | 348.74 | Joback Calculated Property |
| η | 0.0004813 | Pa×s | 389.09 | Joback Calculated Property |
| η | 0.0003218 | Pa×s | 429.43 | Joback Calculated Property |
| η | 0.0002306 | Pa×s | 469.77 | Joback Calculated Property |
| η | 0.0001742 | Pa×s | 510.12 | Joback Calculated Property |
| η | 0.0001371 | Pa×s | 550.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methoxybenzyl alcohol, n-butyl ether.
Sources
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