- InChI
- InChI=1S/C11H16O3/c1-7(2)8-5-10(13-3)11(14-4)6-9(8)12/h5-7,12H,1-4H3
- InChI Key
- NRQXZAIDQWCSHP-UHFFFAOYSA-N
- Formula
- C11H16O3
- SMILES
- COc1cc(O)c(C(C)C)cc1OC
- Molecular Weight1
- 196.24
- 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° | -232.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -503.81 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.13 | kJ/mol | Joback Calculated Property |
| log10WS | -2.44 | Crippen Calculated Property | |
| logPoct/wat | 2.533 | Crippen Calculated Property | |
| McVol | 159.700 | ml/mol | McGowan Calculated Property |
| Pc | 2921.84 | kPa | Joback Calculated Property |
| Inp | [1400.00; 1400.00] |
|
|
| Inp | 1400.00 | NIST | |
| Inp | 1400.00 | NIST | |
| Tboil | 612.74 | K | Joback Calculated Property |
| Tc | 828.87 | K | Joback Calculated Property |
| Tfus | 406.37 | K | Joback Calculated Property |
| Vc | 0.539 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [406.33; 479.13] | J/mol×K | [612.74; 828.87] |
|
| Cp,gas | 406.33 | J/mol×K | 612.74 | Joback Calculated Property |
| Cp,gas | 420.16 | J/mol×K | 648.76 | Joback Calculated Property |
| Cp,gas | 433.27 | J/mol×K | 684.78 | Joback Calculated Property |
| Cp,gas | 445.69 | J/mol×K | 720.81 | Joback Calculated Property |
| Cp,gas | 457.45 | J/mol×K | 756.83 | Joback Calculated Property |
| Cp,gas | 468.59 | J/mol×K | 792.85 | Joback Calculated Property |
| Cp,gas | 479.13 | J/mol×K | 828.87 | Joback Calculated Property |
| η | [0.0000202; 0.0005911] | Pa×s | [406.37; 612.74] |
|
| η | 0.0005911 | Pa×s | 406.37 | Joback Calculated Property |
| η | 0.0002705 | Pa×s | 440.76 | Joback Calculated Property |
| η | 0.0001386 | Pa×s | 475.16 | Joback Calculated Property |
| η | 0.0000777 | Pa×s | 509.56 | Joback Calculated Property |
| η | 0.0000469 | Pa×s | 543.95 | Joback Calculated Property |
| η | 0.0000300 | Pa×s | 578.35 | Joback Calculated Property |
| η | 0.0000202 | Pa×s | 612.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4,5-Dimethoxy-2-(2-propyl)phenol.
Sources
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