- InChI
- InChI=1S/C11H11ClO2/c12-9-6-1-2-7-10(9)14-11(13)8-4-3-5-8/h1-2,6-8H,3-5H2
- InChI Key
- QQMAENAUZRPEMZ-UHFFFAOYSA-N
- Formula
- C11H11ClO2
- SMILES
- O=C(Oc1ccccc1Cl)C1CCC1
- Molecular Weight1
- 210.66
- ω : Acentric Factor.
- 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).
- 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 | 0.5119 | Relay (1.0) Calculated Property | |
| ΔfG° | -52.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -305.09 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.48 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.75 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.54 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.046 | Crippen Calculated Property | |
| McVol | 150.910 | ml/mol | McGowan Calculated Property |
| Pc | 3107.10 | kPa | Joback Calculated Property |
| Inp | [1527.00; 1527.00] |
|
|
| Inp | 1527.00 | NIST | |
| Inp | 1527.00 | NIST | |
| Tboil | 539.42 | K | Relay (1.0) Calculated Property |
| Tc | 807.13 | K | Relay (1.0) Calculated Property |
| Tfus | 291.44 | K | Relay (1.0) Calculated Property |
| Vc | 0.548 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [358.89; 431.79] | J/mol×K | [607.47; 845.52] |
|
| Cp,gas | 358.89 | J/mol×K | 607.47 | Joback Calculated Property |
| Cp,gas | 373.56 | J/mol×K | 647.14 | Joback Calculated Property |
| Cp,gas | 387.15 | J/mol×K | 686.82 | Joback Calculated Property |
| Cp,gas | 399.72 | J/mol×K | 726.49 | Joback Calculated Property |
| Cp,gas | 411.32 | J/mol×K | 766.17 | Joback Calculated Property |
| Cp,gas | 421.99 | J/mol×K | 805.84 | Joback Calculated Property |
| Cp,gas | 431.79 | J/mol×K | 845.52 | Joback Calculated Property |
| η | [0.0003521; 0.0018581] | Pa×s | [369.17; 607.47] |
|
| η | 0.0018581 | Pa×s | 369.17 | Joback Calculated Property |
| η | 0.0012308 | Pa×s | 408.89 | Joback Calculated Property |
| η | 0.0008770 | Pa×s | 448.60 | Joback Calculated Property |
| η | 0.0006603 | Pa×s | 488.32 | Joback Calculated Property |
| η | 0.0005188 | Pa×s | 528.04 | Joback Calculated Property |
| η | 0.0004216 | Pa×s | 567.75 | Joback Calculated Property |
| η | 0.0003521 | Pa×s | 607.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclobutanecarboxylic acid, 2-chlorophenyl ester.
Sources
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