- InChI
- InChI=1S/C15H15ClO2/c16-10-4-3-7-15(17)18-14-9-8-12-5-1-2-6-13(12)11-14/h1-2,5-6,8-9,11H,3-4,7,10H2
- InChI Key
- ZCUGJMUORSUDHD-UHFFFAOYSA-N
- Formula
- C15H15ClO2
- SMILES
- O=C(CCCCCl)Oc1ccc2ccccc2c1
- Molecular Weight1
- 262.73
- 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° | 39.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -197.34 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.10 | kJ/mol | Joback Calculated Property |
| log10WS | -5.00 | Crippen Calculated Property | |
| logPoct/wat | 4.154 | Crippen Calculated Property | |
| McVol | 198.670 | ml/mol | McGowan Calculated Property |
| Pc | 2293.71 | kPa | Joback Calculated Property |
| Inp | 2175.00 | NIST | |
| Tboil | 706.96 | K | Joback Calculated Property |
| Tc | 931.95 | K | Joback Calculated Property |
| Tfus | 432.53 | K | Joback Calculated Property |
| Vc | 0.762 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [510.81; 580.86] | J/mol×K | [706.96; 931.95] | 
|
| Cp,gas | 510.81 | J/mol×K | 706.96 | Joback Calculated Property |
| Cp,gas | 524.74 | J/mol×K | 744.46 | Joback Calculated Property |
| Cp,gas | 537.69 | J/mol×K | 781.96 | Joback Calculated Property |
| Cp,gas | 549.71 | J/mol×K | 819.46 | Joback Calculated Property |
| Cp,gas | 560.87 | J/mol×K | 856.95 | Joback Calculated Property |
| Cp,gas | 571.24 | J/mol×K | 894.45 | Joback Calculated Property |
| Cp,gas | 580.86 | J/mol×K | 931.95 | Joback Calculated Property |
| η | [0.0002247; 0.0012897] | Pa×s | [432.53; 706.96] |
|
| η | 0.0012897 | Pa×s | 432.53 | Joback Calculated Property |
| η | 0.0008386 | Pa×s | 478.27 | Joback Calculated Property |
| η | 0.0005878 | Pa×s | 524.01 | Joback Calculated Property |
| η | 0.0004362 | Pa×s | 569.75 | Joback Calculated Property |
| η | 0.0003384 | Pa×s | 615.48 | Joback Calculated Property |
| η | 0.0002719 | Pa×s | 661.22 | Joback Calculated Property |
| η | 0.0002247 | Pa×s | 706.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-Chlorovaleric acid, 2-naphthyl ester.
Sources
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