- InChI
- InChI=1S/C21H42/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-19-16-17-20-21/h21H,2-20H2,1H3
- InChI Key
- YUMSFAHUVUYTKV-UHFFFAOYSA-N
- Formula
- C21H42
- SMILES
- CCCCCCCCCCCCCCCCC1CCCC1
- Molecular Weight1
- 294.56
- CAS
- 6812-39-1
- Other Names
-
- HEXADECYLCYCLOPENTANE
- n-Hexadecylcyclopentane
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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.
- I : 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 |
|---|---|---|---|
| ΔcH°liquid | -13850.80 ± 3.30 | kJ/mol | NIST |
| ΔfG° | 162.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -415.60 ± 3.60 | kJ/mol | NIST |
| ΔfusH° | 44.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.30 | kJ/mol | NIST |
| log10WS | -8.27 | Crippen Calculated Property | |
| logPoct/wat | 8.048 | Crippen Calculated Property | |
| McVol | 295.890 | ml/mol | McGowan Calculated Property |
| Pc | 1072.17 | kPa | Joback Calculated Property |
| Inp | [2162.00; 2175.90] |
|
|
| Inp | 2162.00 | NIST | |
| Inp | 2175.90 | NIST | |
| Inp | 2167.40 | NIST | |
| Inp | 2162.00 | NIST | |
| I | 2184.40 | NIST | |
| Tboil | 695.16 | K | Joback Calculated Property |
| Tc | 869.82 | K | Joback Calculated Property |
| Tfus | [292.70; 292.70] | K |
|
| Tfus | 292.70 ± 1.00 | K | NIST |
| Tfus | 292.70 ± 1.00 | K | NIST |
| Vc | 1.153 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [895.70; 1016.86] | J/mol×K | [695.16; 869.82] |
|
| Cp,gas | 895.70 | J/mol×K | 695.16 | Joback Calculated Property |
| Cp,gas | 918.47 | J/mol×K | 724.27 | Joback Calculated Property |
| Cp,gas | 940.16 | J/mol×K | 753.38 | Joback Calculated Property |
| Cp,gas | 960.80 | J/mol×K | 782.49 | Joback Calculated Property |
| Cp,gas | 980.44 | J/mol×K | 811.60 | Joback Calculated Property |
| Cp,gas | 999.11 | J/mol×K | 840.71 | Joback Calculated Property |
| Cp,gas | 1016.86 | J/mol×K | 869.82 | Joback Calculated Property |
| η | [0.0001236; 0.0035403] | Pa×s | [337.33; 695.16] |
|
| η | 0.0035403 | Pa×s | 337.33 | Joback Calculated Property |
| η | 0.0013297 | Pa×s | 396.97 | Joback Calculated Property |
| η | 0.0006450 | Pa×s | 456.61 | Joback Calculated Property |
| η | 0.0003698 | Pa×s | 516.25 | Joback Calculated Property |
| η | 0.0002379 | Pa×s | 575.88 | Joback Calculated Property |
| η | 0.0001663 | Pa×s | 635.52 | Joback Calculated Property |
| η | 0.0001236 | Pa×s | 695.16 | Joback Calculated Property |
| ΔvapH | 79.20 | kJ/mol | 586.00 | NIST |
Similar Compounds
Find more compounds similar to Cyclopentane, hexadecyl-.
Sources
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