- InChI
- InChI=1S/C20H42/c1-17(2)11-9-15-19(5)13-7-8-14-20(6)16-10-12-18(3)4/h17-20H,7-16H2,1-6H3
- InChI Key
- KKFZXXATNGJPJS-UHFFFAOYSA-N
- Formula
- C20H42
- SMILES
- CC(C)CCCC(C)CCCCC(C)CCCC(C)C
- Molecular Weight1
- 282.55
- CAS
- 504-44-9
- Other Names
-
- Crocetane
- 2,6,11,15-Tetramethylhexadecane
- 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° | 107.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -477.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.56 | kJ/mol | Joback Calculated Property |
| log10WS | -7.23 | Crippen Calculated Property | |
| logPoct/wat | 7.472 | Crippen Calculated Property | |
| McVol | 292.660 | ml/mol | McGowan Calculated Property |
| Pc | 1036.57 | kPa | Joback Calculated Property |
| Inp | [1792.00; 1813.00] |
|
|
| Inp | 1792.00 | NIST | |
| Inp | 1813.00 | NIST | |
| Inp | 1792.00 | NIST | |
| Tboil | 592.00 ± 0.60 | K | NIST |
| Tc | 822.89 | K | Joback Calculated Property |
| Tfus | 255.16 | K | Joback Calculated Property |
| Vc | 1.131 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [841.81; 960.09] | J/mol×K | [655.24; 822.89] |
|
| Cp,gas | 841.81 | J/mol×K | 655.24 | Joback Calculated Property |
| Cp,gas | 863.83 | J/mol×K | 683.18 | Joback Calculated Property |
| Cp,gas | 884.89 | J/mol×K | 711.12 | Joback Calculated Property |
| Cp,gas | 905.01 | J/mol×K | 739.06 | Joback Calculated Property |
| Cp,gas | 924.24 | J/mol×K | 767.00 | Joback Calculated Property |
| Cp,gas | 942.58 | J/mol×K | 794.94 | Joback Calculated Property |
| Cp,gas | 960.09 | J/mol×K | 822.89 | Joback Calculated Property |
| η | [0.0000722; 0.0197594] | Pa×s | [255.16; 655.24] |
|
| η | 0.0197594 | Pa×s | 255.16 | Joback Calculated Property |
| η | 0.0029435 | Pa×s | 321.84 | Joback Calculated Property |
| η | 0.0008429 | Pa×s | 388.52 | Joback Calculated Property |
| η | 0.0003482 | Pa×s | 455.20 | Joback Calculated Property |
| η | 0.0001803 | Pa×s | 521.88 | Joback Calculated Property |
| η | 0.0001084 | Pa×s | 588.56 | Joback Calculated Property |
| η | 0.0000722 | Pa×s | 655.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexadecane, 2,6,11,15-tetramethyl-.
Sources
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