- InChI
- InChI=1S/C14H22O2/c1-5-6-7-8-12-9-10-13(15-3)11(2)14(12)16-4/h9-10H,5-8H2,1-4H3
- InChI Key
- BJKIXSUOHIMKOW-UHFFFAOYSA-N
- Formula
- C14H22O2
- SMILES
- CCCCCc1ccc(OC)c(C)c1OC
- Molecular Weight1
- 222.32
- 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° | -59.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -394.61 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.84 | kJ/mol | Joback Calculated Property |
| log10WS | -4.25 | Crippen Calculated Property | |
| logPoct/wat | 3.745 | Crippen Calculated Property | |
| McVol | 196.100 | ml/mol | McGowan Calculated Property |
| Pc | 1874.03 | kPa | Joback Calculated Property |
| Inp | [1619.00; 1619.00] |
|
|
| Inp | 1619.00 | NIST | |
| Inp | 1619.00 | NIST | |
| Tboil | 606.18 | K | Joback Calculated Property |
| Tc | 800.12 | K | Joback Calculated Property |
| Tfus | 355.98 | K | Joback Calculated Property |
| Vc | 0.748 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [498.22; 587.16] | J/mol×K | [606.18; 800.12] |
|
| Cp,gas | 498.22 | J/mol×K | 606.18 | Joback Calculated Property |
| Cp,gas | 514.89 | J/mol×K | 638.50 | Joback Calculated Property |
| Cp,gas | 530.82 | J/mol×K | 670.83 | Joback Calculated Property |
| Cp,gas | 546.01 | J/mol×K | 703.15 | Joback Calculated Property |
| Cp,gas | 560.47 | J/mol×K | 735.47 | Joback Calculated Property |
| Cp,gas | 574.18 | J/mol×K | 767.80 | Joback Calculated Property |
| Cp,gas | 587.16 | J/mol×K | 800.12 | Joback Calculated Property |
| η | [0.0001109; 0.0008461] | Pa×s | [355.98; 606.18] |
|
| η | 0.0008461 | Pa×s | 355.98 | Joback Calculated Property |
| η | 0.0005050 | Pa×s | 397.68 | Joback Calculated Property |
| η | 0.0003324 | Pa×s | 439.38 | Joback Calculated Property |
| η | 0.0002352 | Pa×s | 481.08 | Joback Calculated Property |
| η | 0.0001759 | Pa×s | 522.78 | Joback Calculated Property |
| η | 0.0001373 | Pa×s | 564.48 | Joback Calculated Property |
| η | 0.0001109 | Pa×s | 606.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,3-dimethoxy-2-methyl-4-pentyl.
Sources
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