- InChI
- InChI=1S/C9H13ClF2O4/c1-8(2)15-5-6(16-8)3-4-14-7(13)9(10,11)12/h6H,3-5H2,1-2H3
- InChI Key
- KCPIJFSNJRKXHR-UHFFFAOYSA-N
- Formula
- C9H13ClF2O4
- SMILES
- CC1(C)OCC(CCOC(=O)C(F)(F)Cl)O1
- Molecular Weight1
- 258.65
- 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).
- 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 |
|---|---|---|---|
| ω | 0.4720 | Relay (... Calculated Property | |
| ΔfG° | -756.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1200.40 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 29.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.85 | kJ/mol | Relay (... Calculated Property |
| IE | 10.30 | eV | Relay (... Calculated Property |
| log10WS | -1.44 | Relay (... Calculated Property | |
| logPoct/wat | 1.903 | Crippen Calculated Property | |
| McVol | 161.770 | ml/mol | McGowan Calculated Property |
| Pc | 2576.72 | kPa | Joback Calculated Property |
| Inp | [1214.00; 1214.00] |
|
|
| Inp | 1214.00 | NIST | |
| Inp | 1214.00 | NIST | |
| Tboil | 479.33 | K | Relay (... Calculated Property |
| Tc | 644.43 | K | Relay (... Calculated Property |
| Tfus | 254.27 | K | Relay (... Calculated Property |
| Vc | 0.633 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [418.95; 489.69] | J/mol×K | [579.10; 782.08] |
|
| Cp,gas | 418.95 | J/mol×K | 579.10 | Joback Calculated Property |
| Cp,gas | 432.55 | J/mol×K | 612.93 | Joback Calculated Property |
| Cp,gas | 445.30 | J/mol×K | 646.76 | Joback Calculated Property |
| Cp,gas | 457.29 | J/mol×K | 680.59 | Joback Calculated Property |
| Cp,gas | 468.62 | J/mol×K | 714.42 | Joback Calculated Property |
| Cp,gas | 479.39 | J/mol×K | 748.25 | Joback Calculated Property |
| Cp,gas | 489.69 | J/mol×K | 782.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane, chlorodifluoroacetate.
Sources
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