- InChI
- InChI=1S/C22H46/c1-5-9-11-13-15-19-21(17-7-3)22(18-8-4)20-16-14-12-10-6-2/h21-22H,5-20H2,1-4H3
- InChI Key
- RMLZIZGEJUPVGW-UHFFFAOYSA-N
- Formula
- C22H46
- SMILES
- CCCCCCCC(CCC)C(CCC)CCCCCCC
- Molecular Weight1
- 310.60
- 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 | 0.8178 | Relay (1.0) Calculated Property | |
| ΔfG° | 129.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -467.74 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.38 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.76 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.540 | Crippen Calculated Property | |
| McVol | 320.840 | ml/mol | McGowan Calculated Property |
| Pc | 910.53 | kPa | Joback Calculated Property |
| Inp | 1934.00 | NIST | |
| Tboil | 589.86 | K | Relay (1.0) Calculated Property |
| Tc | 758.79 | K | Relay (1.0) Calculated Property |
| Tfus | 241.17 | K | Relay (1.0) Calculated Property |
| Vc | 1.214 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [962.91; 1082.10] | J/mol×K | [702.08; 868.33] | 
|
| Cp,gas | 962.91 | J/mol×K | 702.08 | Joback Calculated Property |
| Cp,gas | 985.10 | J/mol×K | 729.79 | Joback Calculated Property |
| Cp,gas | 1006.32 | J/mol×K | 757.50 | Joback Calculated Property |
| Cp,gas | 1026.60 | J/mol×K | 785.20 | Joback Calculated Property |
| Cp,gas | 1045.96 | J/mol×K | 812.91 | Joback Calculated Property |
| Cp,gas | 1064.46 | J/mol×K | 840.62 | Joback Calculated Property |
| Cp,gas | 1082.10 | J/mol×K | 868.33 | Joback Calculated Property |
| η | [0.0000645; 0.0057276] | Pa×s | [307.70; 702.08] |
|
| η | 0.0057276 | Pa×s | 307.70 | Joback Calculated Property |
| η | 0.0014042 | Pa×s | 373.43 | Joback Calculated Property |
| η | 0.0005244 | Pa×s | 439.16 | Joback Calculated Property |
| η | 0.0002531 | Pa×s | 504.89 | Joback Calculated Property |
| η | 0.0001445 | Pa×s | 570.62 | Joback Calculated Property |
| η | 0.0000926 | Pa×s | 636.35 | Joback Calculated Property |
| η | 0.0000645 | Pa×s | 702.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexadecane, 8,9-dipropyl.
Sources
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