- InChI
- InChI=1S/C29H47ClO5/c1-2-3-4-5-6-7-10-13-18-23-34-28(31)21-14-11-8-9-12-15-22-29(32)35-25-24-33-27-20-17-16-19-26(27)30/h16-17,19-20H,2-15,18,21-25H2,1H3
- InChI Key
- MDNOKWIULWAYBZ-UHFFFAOYSA-N
- Formula
- C29H47ClO5
- SMILES
-
CCCCCCCCCCCOC(=O)CCCCCCCCC(=O)
OCCOc1ccccc1Cl - Molecular Weight1
- 511.13
- 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° | -288.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1054.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 75.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.19 | kJ/mol | Joback Calculated Property |
| log10WS | -9.21 | Crippen Calculated Property | |
| logPoct/wat | 8.457 | Crippen Calculated Property | |
| McVol | 428.700 | ml/mol | McGowan Calculated Property |
| Pc | 751.43 | kPa | Joback Calculated Property |
| Inp | [3432.00; 3432.00] |
|
|
| Inp | 3432.00 | NIST | |
| Inp | 3432.00 | NIST | |
| Tboil | 1107.01 | K | Joback Calculated Property |
| Tc | 1374.89 | K | Joback Calculated Property |
| Tfus | 652.00 | K | Joback Calculated Property |
| Vc | 1.667 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1484.65; 1546.16] | J/mol×K | [1107.01; 1374.89] |
|
| Cp,gas | 1484.65 | J/mol×K | 1107.01 | Joback Calculated Property |
| Cp,gas | 1500.71 | J/mol×K | 1151.66 | Joback Calculated Property |
| Cp,gas | 1514.33 | J/mol×K | 1196.30 | Joback Calculated Property |
| Cp,gas | 1525.60 | J/mol×K | 1240.95 | Joback Calculated Property |
| Cp,gas | 1534.61 | J/mol×K | 1285.60 | Joback Calculated Property |
| Cp,gas | 1541.43 | J/mol×K | 1330.24 | Joback Calculated Property |
| Cp,gas | 1546.16 | J/mol×K | 1374.89 | Joback Calculated Property |
| η | [0.0000086; 0.0001112] | Pa×s | [652.00; 1107.01] |
|
| η | 0.0001112 | Pa×s | 652.00 | Joback Calculated Property |
| η | 0.0000582 | Pa×s | 727.83 | Joback Calculated Property |
| η | 0.0000344 | Pa×s | 803.67 | Joback Calculated Property |
| η | 0.0000223 | Pa×s | 879.50 | Joback Calculated Property |
| η | 0.0000155 | Pa×s | 955.34 | Joback Calculated Property |
| η | 0.0000113 | Pa×s | 1031.17 | Joback Calculated Property |
| η | 0.0000086 | Pa×s | 1107.01 | Joback Calculated Property |
Similar Compounds
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Sources
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