- InChI
- InChI=1S/C10H9ClO4/c11-5-6-15-10(14)8-4-2-1-3-7(8)9(12)13/h1-4H,5-6H2,(H,12,13)
- InChI Key
- YTFGPKHKZPYPFL-UHFFFAOYSA-N
- Formula
- C10H9ClO4
- SMILES
- O=C(O)c1ccccc1C(=O)OCCCl
- Molecular Weight1
- 228.63
- CAS
- 6139-60-2
- 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° | -375.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -550.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.76 | kJ/mol | Joback Calculated Property |
| log10WS | -2.35 | Crippen Calculated Property | |
| logPoct/wat | 1.780 | Crippen Calculated Property | |
| McVol | 155.120 | ml/mol | McGowan Calculated Property |
| Pc | 3468.36 | kPa | Joback Calculated Property |
| Inp | [1873.00; 1873.00] |
|
|
| Inp | 1873.00 | NIST | |
| Inp | 1873.00 | NIST | |
| Tboil | 719.63 | K | Joback Calculated Property |
| Tc | 929.26 | K | Joback Calculated Property |
| Tfus | 454.23 | K | Joback Calculated Property |
| Vc | 0.586 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [382.91; 427.07] | J/mol×K | [719.63; 929.26] |
|
| Cp,gas | 382.91 | J/mol×K | 719.63 | Joback Calculated Property |
| Cp,gas | 391.84 | J/mol×K | 754.57 | Joback Calculated Property |
| Cp,gas | 400.11 | J/mol×K | 789.51 | Joback Calculated Property |
| Cp,gas | 407.76 | J/mol×K | 824.45 | Joback Calculated Property |
| Cp,gas | 414.80 | J/mol×K | 859.38 | Joback Calculated Property |
| Cp,gas | 421.23 | J/mol×K | 894.32 | Joback Calculated Property |
| Cp,gas | 427.07 | J/mol×K | 929.26 | Joback Calculated Property |
| η | [0.0000496; 0.0010322] | Pa×s | [454.23; 719.63] |
|
| η | 0.0010322 | Pa×s | 454.23 | Joback Calculated Property |
| η | 0.0004971 | Pa×s | 498.46 | Joback Calculated Property |
| η | 0.0002697 | Pa×s | 542.70 | Joback Calculated Property |
| η | 0.0001605 | Pa×s | 586.93 | Joback Calculated Property |
| η | 0.0001027 | Pa×s | 631.16 | Joback Calculated Property |
| η | 0.0000697 | Pa×s | 675.40 | Joback Calculated Property |
| η | 0.0000496 | Pa×s | 719.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-((2-Chloroethoxy)carbonyl)benzoic acid.
Sources
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