- InChI
- InChI=1S/C6H12O2/c1-3-6-7-4-5(2)8-6/h5-6H,3-4H2,1-2H3/t5-,6+/m1/s1
- InChI Key
- CSZCLQLJVFLXLI-RITPCOANSA-N
- Formula
- C6H12O2
- SMILES
- CCC1OCC(C)O1
- Molecular Weight1
- 116.16
- CAS
- 4359-46-0
- Other Names
-
- Propanal, cyclic 1-methyl-1,2-ethanediyl acetal
- 2-Ethyl-4-methyl-1,3-dioxolane
- 1,3-Dioxolane, 2-ethyl-4-methyl, cis
- 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).
- 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° | -143.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -391.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 37.92 | kJ/mol | Joback Calculated Property |
| log10WS | -1.12 | Crippen Calculated Property | |
| logPoct/wat | 1.158 | Crippen Calculated Property | |
| McVol | 96.280 | ml/mol | McGowan Calculated Property |
| Pc | 3607.21 | kPa | Joback Calculated Property |
| Inp | [773.00; 782.00] |
|
|
| Inp | 778.00 | NIST | |
| Inp | 782.00 | NIST | |
| Inp | 773.00 | NIST | |
| Inp | 773.00 | NIST | |
| Inp | 778.00 | NIST | |
| Tboil | 401.19 | K | Joback Calculated Property |
| Tc | 597.60 | K | Joback Calculated Property |
| Tfus | 217.18 | K | Joback Calculated Property |
| Vc | 0.353 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [195.22; 267.43] | J/mol×K | [401.19; 597.60] |
|
| Cp,gas | 195.22 | J/mol×K | 401.19 | Joback Calculated Property |
| Cp,gas | 208.70 | J/mol×K | 433.92 | Joback Calculated Property |
| Cp,gas | 221.59 | J/mol×K | 466.66 | Joback Calculated Property |
| Cp,gas | 233.89 | J/mol×K | 499.39 | Joback Calculated Property |
| Cp,gas | 245.63 | J/mol×K | 532.13 | Joback Calculated Property |
| Cp,gas | 256.80 | J/mol×K | 564.86 | Joback Calculated Property |
| Cp,gas | 267.43 | J/mol×K | 597.60 | Joback Calculated Property |
| η | [0.0004046; 0.0032903] | Pa×s | [217.18; 401.19] |
|
| η | 0.0032903 | Pa×s | 217.18 | Joback Calculated Property |
| η | 0.0018693 | Pa×s | 247.85 | Joback Calculated Property |
| η | 0.0012029 | Pa×s | 278.52 | Joback Calculated Property |
| η | 0.0008448 | Pa×s | 309.19 | Joback Calculated Property |
| η | 0.0006323 | Pa×s | 339.85 | Joback Calculated Property |
| η | 0.0004966 | Pa×s | 370.52 | Joback Calculated Property |
| η | 0.0004046 | Pa×s | 401.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Dioxolane, 2-ethyl-4-methyl-.
Sources
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