- InChI
- InChI=1S/C12H21ClO3/c1-4-5-6-7-8-9-16-11(15)12(2,3)10(13)14/h4-9H2,1-3H3
- InChI Key
- GVVJLYXWQBWNLX-UHFFFAOYSA-N
- Formula
- C12H21ClO3
- SMILES
- CCCCCCCOC(=O)C(C)(C)C(=O)Cl
- Molecular Weight1
- 248.75
- 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 | 0.6449 | Relay (1.0) Calculated Property | |
| ΔfG° | -321.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -756.49 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.01 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.74 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.17 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.292 | Crippen Calculated Property | |
| McVol | 201.190 | ml/mol | McGowan Calculated Property |
| Pc | 1925.36 | kPa | Joback Calculated Property |
| Inp | 1500.00 | NIST | |
| Tboil | 513.63 | K | Relay (1.0) Calculated Property |
| Tc | 710.75 | K | Relay (1.0) Calculated Property |
| Tfus | 256.01 | K | Relay (1.0) Calculated Property |
| Vc | 0.751 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [521.50; 597.22] | J/mol×K | [638.32; 829.20] | 
|
| Cp,gas | 521.50 | J/mol×K | 638.32 | Joback Calculated Property |
| Cp,gas | 536.01 | J/mol×K | 670.13 | Joback Calculated Property |
| Cp,gas | 549.73 | J/mol×K | 701.95 | Joback Calculated Property |
| Cp,gas | 562.69 | J/mol×K | 733.76 | Joback Calculated Property |
| Cp,gas | 574.90 | J/mol×K | 765.57 | Joback Calculated Property |
| Cp,gas | 586.40 | J/mol×K | 797.39 | Joback Calculated Property |
| Cp,gas | 597.22 | J/mol×K | 829.20 | Joback Calculated Property |
| η | [0.0001561; 0.0021798] | Pa×s | [379.43; 638.32] |
|
| η | 0.0021798 | Pa×s | 379.43 | Joback Calculated Property |
| η | 0.0011224 | Pa×s | 422.58 | Joback Calculated Property |
| η | 0.0006535 | Pa×s | 465.73 | Joback Calculated Property |
| η | 0.0004171 | Pa×s | 508.88 | Joback Calculated Property |
| η | 0.0002855 | Pa×s | 552.02 | Joback Calculated Property |
| η | 0.0002065 | Pa×s | 595.17 | Joback Calculated Property |
| η | 0.0001561 | Pa×s | 638.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, monochloride, heptyl ester.
Sources
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