- InChI
- InChI=1S/C12H13ClO/c13-11-8-4-3-7-10(11)12(14)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2
- InChI Key
- QIJMMRNZBJHXRI-UHFFFAOYSA-N
- Formula
- C12H13ClO
- SMILES
- O=C(c1ccccc1Cl)C1CCCC1
- Molecular Weight1
- 208.68
- CAS
- 6740-85-8
- Other Names
-
- 2-Chlorophenyl cyclopentyl ketone
- Methanone, (2-chlorophenyl)cyclopentyl-
- 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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° | 48.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -133.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.63 | kJ/mol | Joback Calculated Property |
| log10WS | -4.14 | Crippen Calculated Property | |
| logPoct/wat | 3.713 | Crippen Calculated Property | |
| McVol | 159.130 | ml/mol | McGowan Calculated Property |
| Pc | 2928.17 | kPa | Joback Calculated Property |
| Tboil | 612.20 | K | Joback Calculated Property |
| Tc | 857.24 | K | Joback Calculated Property |
| Tfus | 354.69 | K | Joback Calculated Property |
| Vc | 0.596 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [383.99; 466.11] | J/mol×K | [612.20; 857.24] | 
|
| Cp,gas | 383.99 | J/mol×K | 612.20 | Joback Calculated Property |
| Cp,gas | 400.66 | J/mol×K | 653.04 | Joback Calculated Property |
| Cp,gas | 416.04 | J/mol×K | 693.88 | Joback Calculated Property |
| Cp,gas | 430.21 | J/mol×K | 734.72 | Joback Calculated Property |
| Cp,gas | 443.23 | J/mol×K | 775.56 | Joback Calculated Property |
| Cp,gas | 455.18 | J/mol×K | 816.40 | Joback Calculated Property |
| Cp,gas | 466.11 | J/mol×K | 857.24 | Joback Calculated Property |
| η | [0.0003066; 0.0024451] | Pa×s | [354.69; 612.20] |
|
| η | 0.0024451 | Pa×s | 354.69 | Joback Calculated Property |
| η | 0.0014351 | Pa×s | 397.61 | Joback Calculated Property |
| η | 0.0009345 | Pa×s | 440.53 | Joback Calculated Property |
| η | 0.0006566 | Pa×s | 483.45 | Joback Calculated Property |
| η | 0.0004887 | Pa×s | 526.36 | Joback Calculated Property |
| η | 0.0003803 | Pa×s | 569.28 | Joback Calculated Property |
| η | 0.0003066 | Pa×s | 612.20 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 369.50 ± 0.50 | K | 0.04 | NIST |
Similar Compounds
Find more compounds similar to o-Chlorophenyl cyclopentyl ketone.
Sources
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