- InChI
- InChI=1S/C9H18O/c1-3-5-6-7-8-9-10-4-2/h8-9H,3-7H2,1-2H3/b9-8+
- InChI Key
- SDTIAHWPSZKYHU-CMDGGOBGSA-N
- Formula
- C9H18O
- SMILES
- CCCCC/C=C/OCC
- Molecular Weight1
- 142.24
- 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 | 0.4418 | Relay (1.0) Calculated Property | |
| ΔfG° | 0.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -266.02 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.51 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.33 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.95 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.117 | Crippen Calculated Property | |
| McVol | 139.240 | ml/mol | McGowan Calculated Property |
| Pc | 2386.52 | kPa | Joback Calculated Property |
| Tboil | 427.87 | K | Relay (1.0) Calculated Property |
| Tc | 613.49 | K | Relay (1.0) Calculated Property |
| Tfus | 213.89 | K | Relay (1.0) Calculated Property |
| Vc | 0.532 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [197.81; 471.56] | 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 | 6.02500e+00 | |||
| Coefficient B | 8.15640e-01 | |||
| Coefficient C | -4.38600e-04 | |||
| Coefficient D | 8.85000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 197.81 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 243.60 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 284.90 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 321.98 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 355.13 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 384.61 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 410.72 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 433.73 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 453.92 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 471.56 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0040144; 0.0001891] | Pa×s | [208.34; 422.33] |
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 | -1.15475e+01 | |||
| Coefficient B | 1.25621e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 208.34 | |||
| Temperature range, max. | 422.33 | |||
| η | 0.0040144 | Pa×s | 208.34 | Calculated Property |
| η | 0.0021646 | Pa×s | 232.12 | Calculated Property |
| η | 0.0013092 | Pa×s | 255.89 | Calculated Property |
| η | 0.0008625 | Pa×s | 279.67 | Calculated Property |
| η | 0.0006066 | Pa×s | 303.45 | Calculated Property |
| η | 0.0004490 | Pa×s | 327.22 | Calculated Property |
| η | 0.0003462 | Pa×s | 351.00 | Calculated Property |
| η | 0.0002759 | Pa×s | 374.78 | Calculated Property |
| η | 0.0002259 | Pa×s | 398.55 | Calculated Property |
| η | 0.0001891 | Pa×s | 422.33 | Calculated Property |
Similar Compounds
Find more compounds similar to Ether, ethyl 1-heptenyl, (E)-.
Sources
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