- InChI
- InChI=1S/C8H12O3/c1-2-10-8(9)7-5-3-4-6-11-7/h4,6-7H,2-3,5H2,1H3
- InChI Key
- HXBSUCZDAYLJDO-UHFFFAOYSA-N
- Formula
- C8H12O3
- SMILES
- CCOC(=O)C1CCC=CO1
- Molecular Weight1
- 156.18
- CAS
- 83568-11-0
- Other Names
-
- 2H-Pyran-2-carboxylic acid, 3,4-dihydro-, ethyl ester
- 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 |
|---|---|---|---|
| ΔfG° | -249.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -473.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.79 | kJ/mol | Joback Calculated Property |
| IE | 8.60 | eV | NIST |
| log10WS | -1.48 | Crippen Calculated Property | |
| logPoct/wat | 1.242 | Crippen Calculated Property | |
| McVol | 121.730 | ml/mol | McGowan Calculated Property |
| Pc | 3427.87 | kPa | Joback Calculated Property |
| Tboil | 504.39 | K | Joback Calculated Property |
| Tc | 716.76 | K | Joback Calculated Property |
| Tfus | 286.79 | K | Joback Calculated Property |
| Vc | 0.448 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [276.80; 351.95] | J/mol×K | [504.39; 716.76] | 
|
| Cp,gas | 276.80 | J/mol×K | 504.39 | Joback Calculated Property |
| Cp,gas | 291.15 | J/mol×K | 539.78 | Joback Calculated Property |
| Cp,gas | 304.76 | J/mol×K | 575.18 | Joback Calculated Property |
| Cp,gas | 317.64 | J/mol×K | 610.57 | Joback Calculated Property |
| Cp,gas | 329.79 | J/mol×K | 645.97 | Joback Calculated Property |
| Cp,gas | 341.23 | J/mol×K | 681.36 | Joback Calculated Property |
| Cp,gas | 351.95 | J/mol×K | 716.76 | Joback Calculated Property |
| η | [0.0002854; 0.0036127] | Pa×s | [286.79; 504.39] |
|
| η | 0.0036127 | Pa×s | 286.79 | Joback Calculated Property |
| η | 0.0018663 | Pa×s | 323.06 | Joback Calculated Property |
| η | 0.0011016 | Pa×s | 359.32 | Joback Calculated Property |
| η | 0.0007162 | Pa×s | 395.59 | Joback Calculated Property |
| η | 0.0005006 | Pa×s | 431.86 | Joback Calculated Property |
| η | 0.0003698 | Pa×s | 468.12 | Joback Calculated Property |
| η | 0.0002854 | Pa×s | 504.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethyl-3, 4-dihydro-2, -h-pyran carboxylate.
Sources
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