- InChI
- InChI=1S/C7H10O2/c1-5(2)6-3-4-7(8)9-6/h3-6H,1-2H3
- InChI Key
- LWFKYUIZWLTJCA-UHFFFAOYSA-N
- Formula
- C7H10O2
- SMILES
- CC(C)C1C=CC(=O)O1
- Molecular Weight1
- 126.15
- CAS
- 56767-19-2
- Other Names
-
- 5-Isopropyl-5H-furan-2-one
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -136.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -344.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.09 | kJ/mol | Joback Calculated Property |
| log10WS | -1.23 | Crippen Calculated Property | |
| logPoct/wat | 1.124 | Crippen Calculated Property | |
| McVol | 101.770 | ml/mol | McGowan Calculated Property |
| Pc | 3718.02 | kPa | Joback Calculated Property |
| Inp | 1311.00 | NIST | |
| Tboil | 468.33 | K | Joback Calculated Property |
| Tc | 689.64 | K | Joback Calculated Property |
| Tfus | 260.10 | K | Joback Calculated Property |
| Vc | 0.377 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [218.87; 289.99] | J/mol×K | [468.33; 689.64] | 
|
| Cp,gas | 218.87 | J/mol×K | 468.33 | Joback Calculated Property |
| Cp,gas | 232.27 | J/mol×K | 505.22 | Joback Calculated Property |
| Cp,gas | 245.06 | J/mol×K | 542.10 | Joback Calculated Property |
| Cp,gas | 257.22 | J/mol×K | 578.99 | Joback Calculated Property |
| Cp,gas | 268.77 | J/mol×K | 615.87 | Joback Calculated Property |
| Cp,gas | 279.69 | J/mol×K | 652.76 | Joback Calculated Property |
| Cp,gas | 289.99 | J/mol×K | 689.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2(5H)-Furanone, 5-(1-methylethyl)-.
Sources
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