- InChI
- InChI=1S/C6H10O2/c7-6-4-2-1-3-5-8-6/h1,3,6-7H,2,4-5H2
- InChI Key
- JXMYHVAOAIWGIK-UHFFFAOYSA-N
- Formula
- C6H10O2
- SMILES
- OC1CCC=CCO1
- Molecular Weight1
- 114.14
- CAS
- 41793-28-6
- 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 | 0.4488 | Relay (1.0) Calculated Property | |
| ΔfG° | -180.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -313.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.86 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.34 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.24 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.671 | Crippen Calculated Property | |
| McVol | 91.980 | ml/mol | McGowan Calculated Property |
| Pc | 4789.21 | kPa | Joback Calculated Property |
| Tboil | 463.19 | K | Relay (1.0) Calculated Property |
| Tc | 660.79 | K | Relay (1.0) Calculated Property |
| Tfus | 275.09 | K | Relay (1.0) Calculated Property |
| Vc | 0.323 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [200.52; 264.06] | J/mol×K | [478.79; 682.81] | 
|
| Cp,gas | 200.52 | J/mol×K | 478.79 | Joback Calculated Property |
| Cp,gas | 212.64 | J/mol×K | 512.79 | Joback Calculated Property |
| Cp,gas | 224.14 | J/mol×K | 546.80 | Joback Calculated Property |
| Cp,gas | 235.02 | J/mol×K | 580.80 | Joback Calculated Property |
| Cp,gas | 245.29 | J/mol×K | 614.80 | Joback Calculated Property |
| Cp,gas | 254.96 | J/mol×K | 648.81 | Joback Calculated Property |
| Cp,gas | 264.06 | J/mol×K | 682.81 | Joback Calculated Property |
| η | [0.0001800; 0.0647900] | Pa×s | [249.39; 478.79] |
|
| η | 0.0647900 | Pa×s | 249.39 | Joback Calculated Property |
| η | 0.0126560 | Pa×s | 287.62 | Joback Calculated Property |
| η | 0.0036267 | Pa×s | 325.86 | Joback Calculated Property |
| η | 0.0013512 | Pa×s | 364.09 | Joback Calculated Property |
| η | 0.0006073 | Pa×s | 402.32 | Joback Calculated Property |
| η | 0.0003136 | Pa×s | 440.56 | Joback Calculated Property |
| η | 0.0001800 | Pa×s | 478.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,4,7-Tetrahydrooxepin-2-ol.
Sources
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