- InChI
- InChI=1S/C10H20O/c1-4-6-7-8-9-10(5-2)11-3/h5,10H,2,4,6-9H2,1,3H3
- InChI Key
- RSKWWTZKISOAHR-UHFFFAOYSA-N
- Formula
- C10H20O
- SMILES
- C=CC(CCCCCC)OC
- Molecular Weight1
- 156.27
- 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).
- 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 | 0.4436 | Relay (1.0) Calculated Property | |
| ΔfG° | 13.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -265.36 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 18.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.45 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.32 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 3.158 | Crippen Calculated Property | |
| McVol | 153.330 | ml/mol | McGowan Calculated Property |
| Pc | 2173.43 | kPa | Joback Calculated Property |
| Inp | 1122.10 | NIST | |
| Tboil | 446.70 | K | Relay (1.0) Calculated Property |
| Tc | 608.46 | K | Relay (1.0) Calculated Property |
| Tfus | 208.05 | K | Relay (1.0) Calculated Property |
| Vc | 0.564 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [222.90; 525.76] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 1.46250e+01 | |||
| Coefficient B | 8.76540e-01 | |||
| Coefficient C | -4.35300e-04 | |||
| Coefficient D | 6.99000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 222.90 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 273.34 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 319.06 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 360.30 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 397.26 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 430.18 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 459.27 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 484.74 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 506.84 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 525.76 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0061809; 0.0002157] | Pa×s | [207.93; 431.43] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.15634e+01 | |||
| Coefficient B | 1.34679e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 207.93 | |||
| Temperature range, max. | 431.43 | |||
| η | 0.0061809 | Pa×s | 207.93 | Calculated Property |
| η | 0.0030970 | Pa×s | 232.76 | Calculated Property |
| η | 0.0017729 | Pa×s | 257.60 | Calculated Property |
| η | 0.0011195 | Pa×s | 282.43 | Calculated Property |
| η | 0.0007615 | Pa×s | 307.26 | Calculated Property |
| η | 0.0005487 | Pa×s | 332.10 | Calculated Property |
| η | 0.0004138 | Pa×s | 356.93 | Calculated Property |
| η | 0.0003237 | Pa×s | 381.76 | Calculated Property |
| η | 0.0002610 | Pa×s | 406.60 | Calculated Property |
| η | 0.0002157 | Pa×s | 431.43 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Nonen-3-ol, methyl ether.
Sources
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