- InChI
- InChI=1S/C9H14O/c1-7-4-8(2)6-9(5-7)10-3/h5-7H,4H2,1-3H3
- InChI Key
- SNEXTYOVZVMOCT-UHFFFAOYSA-N
- Formula
- C9H14O
- SMILES
- COC1=CC(C)CC(C)=C1
- Molecular Weight1
- 138.21
- CAS
- 98677-98-6
- 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).
- 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 | 0.3296 | Relay (... Calculated Property | |
| ΔfG° | -14.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -130.75 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 13.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.34 | kJ/mol | Relay (... Calculated Property |
| IE | 8.02 | eV | Relay (... Calculated Property |
| log10WS | -2.86 | Relay (... Calculated Property | |
| logPoct/wat | 2.503 | Crippen Calculated Property | |
| McVol | 124.080 | ml/mol | McGowan Calculated Property |
| Pc | 2915.53 | kPa | Joback Calculated Property |
| Tboil | 447.83 | K | Relay (... Calculated Property |
| Tc | 632.54 | K | Relay (... Calculated Property |
| Tfus | 252.08 | K | Relay (... Calculated Property |
| Vc | 0.430 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [255.17; 334.45] | J/mol×K | [455.57; 660.32] | 
|
| Cp,gas | 255.17 | J/mol×K | 455.57 | Joback Calculated Property |
| Cp,gas | 269.90 | J/mol×K | 489.69 | Joback Calculated Property |
| Cp,gas | 284.03 | J/mol×K | 523.82 | Joback Calculated Property |
| Cp,gas | 297.54 | J/mol×K | 557.94 | Joback Calculated Property |
| Cp,gas | 310.45 | J/mol×K | 592.07 | Joback Calculated Property |
| Cp,gas | 322.75 | J/mol×K | 626.19 | Joback Calculated Property |
| Cp,gas | 334.45 | J/mol×K | 660.32 | Joback Calculated Property |
| η | [0.0002022; 0.0015726] | Pa×s | [247.36; 455.57] |
|
| η | 0.0015726 | Pa×s | 247.36 | Joback Calculated Property |
| η | 0.0009053 | Pa×s | 282.06 | Joback Calculated Property |
| η | 0.0005882 | Pa×s | 316.76 | Joback Calculated Property |
| η | 0.0004162 | Pa×s | 351.47 | Joback Calculated Property |
| η | 0.0003133 | Pa×s | 386.17 | Joback Calculated Property |
| η | 0.0002472 | Pa×s | 420.87 | Joback Calculated Property |
| η | 0.0002022 | Pa×s | 455.57 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Methoxy-1,5-dimethyl-1,3-cyclohexadiene.
Sources
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