- InChI
- InChI=1S/C7H14O/c1-4-5-8-6-7(2)3/h2,4-6H2,1,3H3
- InChI Key
- WZZGWPLYYJIOLW-UHFFFAOYSA-N
- Formula
- C7H14O
- SMILES
- C=C(C)COCCC
- Molecular Weight1
- 114.19
- Other Names
-
- Methallyl propyl ether
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.3782 | Relay (1.0) Calculated Property | |
| ΔfG° | -17.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -208.28 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.11 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.18 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.66 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.989 | Crippen Calculated Property | |
| McVol | 111.060 | ml/mol | McGowan Calculated Property |
| Pc | 2890.51 | kPa | Joback Calculated Property |
| Tboil | 377.03 ± 0.30 | K | NIST |
| Tc | 567.16 | K | Relay (1.0) Calculated Property |
| Tfus | 172.54 | K | Relay (1.0) Calculated Property |
| Vc | 0.412 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [159.73; 370.18] | 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 | 1.93430e+01 | |||
| Coefficient B | 5.85540e-01 | |||
| Coefficient C | -2.71200e-04 | |||
| Coefficient D | 3.65000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 159.73 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 194.17 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 225.57 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 254.06 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 279.75 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 302.75 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 323.18 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 341.15 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 356.78 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 370.18 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Propene, 2-methyl-3-propoxy-.
Sources
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