- InChI
- InChI=1S/C6H10O2/c1-6(2)3-4-8-5(6)7/h3-4H2,1-2H3
- InChI Key
- UPVAIJPDWVTFKT-UHFFFAOYSA-N
- Formula
- C6H10O2
- SMILES
- CC1(C)CCOC1=O
- Molecular Weight1
- 114.14
- CAS
- 3709-08-8
- Other Names
-
- Butyric acid, 2,2-dimethyl-4-hydroxy-, g-lactone
- 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).
- 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° | -178.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -361.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 6.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 36.81 | kJ/mol | Joback Calculated Property |
| log10WS | -0.85 | Crippen Calculated Property | |
| logPoct/wat | 0.959 | Crippen Calculated Property | |
| McVol | 91.980 | ml/mol | McGowan Calculated Property |
| Pc | 4200.18 | kPa | Joback Calculated Property |
| Tboil | 446.97 | K | Joback Calculated Property |
| Tc | 673.94 | K | Joback Calculated Property |
| Tfus | 286.97 | K | Joback Calculated Property |
| Vc | 0.339 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [193.83; 261.89] | J/mol×K | [446.97; 673.94] | 
|
| Cp,gas | 193.83 | J/mol×K | 446.97 | Joback Calculated Property |
| Cp,gas | 207.04 | J/mol×K | 484.80 | Joback Calculated Property |
| Cp,gas | 219.39 | J/mol×K | 522.63 | Joback Calculated Property |
| Cp,gas | 230.96 | J/mol×K | 560.45 | Joback Calculated Property |
| Cp,gas | 241.84 | J/mol×K | 598.28 | Joback Calculated Property |
| Cp,gas | 252.12 | J/mol×K | 636.11 | Joback Calculated Property |
| Cp,gas | 261.89 | J/mol×K | 673.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2(3H)-Furanone, dihydro-3,3-dimethyl-.
Sources
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