- InChI
- InChI=1S/C19H34BrClO4/c20-14-7-3-1-5-9-16-24-18(22)12-11-13-19(23)25-17-10-6-2-4-8-15-21/h1-17H2
- InChI Key
- QEMNZYNCLQURJG-UHFFFAOYSA-N
- Formula
- C19H34BrClO4
- SMILES
-
O=C(CCCC(=O)OCCCCCCCBr)OCCCCCC
CCl - Molecular Weight1
- 441.83
- 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° | -356.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -914.50 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 60.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.02 | kJ/mol | Joback Calculated Property |
| log10WS | -6.09 | Crippen Calculated Property | |
| logPoct/wat | 5.778 | Crippen Calculated Property | |
| McVol | 323.190 | ml/mol | McGowan Calculated Property |
| Pc | 1174.44 | kPa | Joback Calculated Property |
| Inp | [2960.00; 2960.00] |
|
|
| Inp | 2960.00 | NIST | |
| Inp | 2960.00 | NIST | |
| Tboil | 890.29 | K | Joback Calculated Property |
| Tc | 1091.00 | K | Joback Calculated Property |
| Tfus | 537.93 | K | Joback Calculated Property |
| Vc | 1.258 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [984.87; 1062.69] | J/mol×K | [890.29; 1091.00] |
|
| Cp,gas | 984.87 | J/mol×K | 890.29 | Joback Calculated Property |
| Cp,gas | 1000.43 | J/mol×K | 923.74 | Joback Calculated Property |
| Cp,gas | 1014.92 | J/mol×K | 957.19 | Joback Calculated Property |
| Cp,gas | 1028.36 | J/mol×K | 990.64 | Joback Calculated Property |
| Cp,gas | 1040.78 | J/mol×K | 1024.09 | Joback Calculated Property |
| Cp,gas | 1052.22 | J/mol×K | 1057.55 | Joback Calculated Property |
| Cp,gas | 1062.69 | J/mol×K | 1091.00 | Joback Calculated Property |
| η | [0.0000403; 0.0004537] | Pa×s | [537.93; 890.29] |
|
| η | 0.0004537 | Pa×s | 537.93 | Joback Calculated Property |
| η | 0.0002484 | Pa×s | 596.66 | Joback Calculated Property |
| η | 0.0001515 | Pa×s | 655.38 | Joback Calculated Property |
| η | 0.0001002 | Pa×s | 714.11 | Joback Calculated Property |
| η | 0.0000706 | Pa×s | 772.84 | Joback Calculated Property |
| η | 0.0000523 | Pa×s | 831.56 | Joback Calculated Property |
| η | 0.0000403 | Pa×s | 890.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 7-chloroheptyl 7-bromoheptyl ester.
Sources
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