- InChI
- InChI=1S/C16H15ClO4/c17-10-11-19-16(18)21-15-8-6-14(7-9-15)20-12-13-4-2-1-3-5-13/h1-9H,10-12H2
- InChI Key
- WAYYAWJZDCWAHE-UHFFFAOYSA-N
- Formula
- C16H15ClO4
- SMILES
-
O=C(OCCCl)Oc1ccc(OCc2ccccc2)cc
1 - Molecular Weight1
- 306.74
- 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° | -156.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -436.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.78 | kJ/mol | Joback Calculated Property |
| log10WS | -4.65 | Crippen Calculated Property | |
| logPoct/wat | 4.020 | Crippen Calculated Property | |
| McVol | 220.200 | ml/mol | McGowan Calculated Property |
| Pc | 2200.01 | kPa | Joback Calculated Property |
| Inp | [2467.00; 2467.00] |
|
|
| Inp | 2467.00 | NIST | |
| Inp | 2467.00 | NIST | |
| Tboil | 782.38 | K | Joback Calculated Property |
| Tc | 1012.63 | K | Joback Calculated Property |
| Tfus | 481.98 | K | Joback Calculated Property |
| Vc | 0.825 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [595.82; 659.91] | J/mol×K | [782.38; 1012.63] |
|
| Cp,gas | 595.82 | J/mol×K | 782.38 | Joback Calculated Property |
| Cp,gas | 609.48 | J/mol×K | 820.75 | Joback Calculated Property |
| Cp,gas | 621.92 | J/mol×K | 859.13 | Joback Calculated Property |
| Cp,gas | 633.17 | J/mol×K | 897.50 | Joback Calculated Property |
| Cp,gas | 643.25 | J/mol×K | 935.88 | Joback Calculated Property |
| Cp,gas | 652.15 | J/mol×K | 974.25 | Joback Calculated Property |
| Cp,gas | 659.91 | J/mol×K | 1012.63 | Joback Calculated Property |
| η | [0.0000655; 0.0005268] | Pa×s | [481.98; 782.38] |
|
| η | 0.0005268 | Pa×s | 481.98 | Joback Calculated Property |
| η | 0.0003161 | Pa×s | 532.05 | Joback Calculated Property |
| η | 0.0002071 | Pa×s | 582.11 | Joback Calculated Property |
| η | 0.0001451 | Pa×s | 632.18 | Joback Calculated Property |
| η | 0.0001071 | Pa×s | 682.25 | Joback Calculated Property |
| η | 0.0000824 | Pa×s | 732.31 | Joback Calculated Property |
| η | 0.0000655 | Pa×s | 782.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, 2-chloroethyl 4-benzyloxyphenyl ester.
Sources
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