- InChI
- InChI=1S/C13H15ClO3/c1-9-5-3-6-11(10(9)2)17-13(16)8-4-7-12(14)15/h3,5-6H,4,7-8H2,1-2H3
- InChI Key
- NOVYBSOSXXNQJC-UHFFFAOYSA-N
- Formula
- C13H15ClO3
- SMILES
- Cc1cccc(OC(=O)CCCC(=O)Cl)c1C
- Molecular Weight1
- 254.71
- 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° | -223.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -471.18 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.42 | kJ/mol | Joback Calculated Property |
| log10WS | -3.92 | Crippen Calculated Property | |
| logPoct/wat | 3.145 | Crippen Calculated Property | |
| McVol | 191.520 | ml/mol | McGowan Calculated Property |
| Pc | 2282.77 | kPa | Joback Calculated Property |
| Inp | 1953.00 | NIST | |
| Tboil | 701.07 | K | Joback Calculated Property |
| Tc | 915.99 | K | Joback Calculated Property |
| Tfus | 439.74 | K | Joback Calculated Property |
| Vc | 0.735 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [486.49; 552.24] | J/mol×K | [701.07; 915.99] | 
|
| Cp,gas | 486.49 | J/mol×K | 701.07 | Joback Calculated Property |
| Cp,gas | 499.52 | J/mol×K | 736.89 | Joback Calculated Property |
| Cp,gas | 511.70 | J/mol×K | 772.71 | Joback Calculated Property |
| Cp,gas | 523.04 | J/mol×K | 808.53 | Joback Calculated Property |
| Cp,gas | 533.57 | J/mol×K | 844.35 | Joback Calculated Property |
| Cp,gas | 543.30 | J/mol×K | 880.17 | Joback Calculated Property |
| Cp,gas | 552.24 | J/mol×K | 915.99 | Joback Calculated Property |
| η | [0.0001576; 0.0010622] | Pa×s | [439.74; 701.07] |
|
| η | 0.0010622 | Pa×s | 439.74 | Joback Calculated Property |
| η | 0.0006696 | Pa×s | 483.30 | Joback Calculated Property |
| η | 0.0004556 | Pa×s | 526.85 | Joback Calculated Property |
| η | 0.0003288 | Pa×s | 570.40 | Joback Calculated Property |
| η | 0.0002485 | Pa×s | 613.96 | Joback Calculated Property |
| η | 0.0001949 | Pa×s | 657.52 | Joback Calculated Property |
| η | 0.0001576 | Pa×s | 701.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, monochloride, 2,3-dimethylphenyl ester.
Sources
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