- InChI
- InChI=1S/C10H14O2/c1-3-4-8-5-9(11)7-10(6-8)12-2/h5-7,11H,3-4H2,1-2H3
- InChI Key
- ILWXLUGUJRYVST-UHFFFAOYSA-N
- Formula
- C10H14O2
- SMILES
- CCCc1cc(O)cc(OC)c1
- Molecular Weight1
- 166.22
- CAS
- 55136-70-4
- 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 | 0.6478 | Relay (1.0) Calculated Property | |
| ΔfG° | -123.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -295.75 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.23 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.17 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.57 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.353 | Crippen Calculated Property | |
| McVol | 139.740 | ml/mol | McGowan Calculated Property |
| Pc | 3341.24 | kPa | Joback Calculated Property |
| Inp | [1504.30; 1504.30] |
|
|
| Inp | 1504.30 | NIST | |
| Inp | 1504.30 | NIST | |
| Tboil | 543.69 | K | Relay (1.0) Calculated Property |
| Tc | 744.79 | K | Relay (1.0) Calculated Property |
| Tfus | 332.43 | K | Relay (1.0) Calculated Property |
| Vc | 0.501 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [335.00; 403.54] | J/mol×K | [562.90; 779.84] |
|
| Cp,gas | 335.00 | J/mol×K | 562.90 | Joback Calculated Property |
| Cp,gas | 348.17 | J/mol×K | 599.06 | Joback Calculated Property |
| Cp,gas | 360.57 | J/mol×K | 635.21 | Joback Calculated Property |
| Cp,gas | 372.26 | J/mol×K | 671.37 | Joback Calculated Property |
| Cp,gas | 383.28 | J/mol×K | 707.52 | Joback Calculated Property |
| Cp,gas | 393.69 | J/mol×K | 743.68 | Joback Calculated Property |
| Cp,gas | 403.54 | J/mol×K | 779.84 | Joback Calculated Property |
| η | [0.0000402; 0.0012473] | Pa×s | [375.35; 562.90] |
|
| η | 0.0012473 | Pa×s | 375.35 | Joback Calculated Property |
| η | 0.0005647 | Pa×s | 406.61 | Joback Calculated Property |
| η | 0.0002863 | Pa×s | 437.87 | Joback Calculated Property |
| η | 0.0001589 | Pa×s | 469.12 | Joback Calculated Property |
| η | 0.0000949 | Pa×s | 500.38 | Joback Calculated Property |
| η | 0.0000602 | Pa×s | 531.64 | Joback Calculated Property |
| η | 0.0000402 | Pa×s | 562.90 | Joback Calculated Property |
Similar Compounds
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Sources
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