- InChI
- InChI=1S/C27H56/c1-4-7-9-11-13-15-16-18-20-22-24-26-27(6-3)25-23-21-19-17-14-12-10-8-5-2/h27H,4-26H2,1-3H3
- InChI Key
- WKSQCFLEIXUOCX-UHFFFAOYSA-N
- Formula
- C27H56
- SMILES
- CCCCCCCCCCCCCC(CC)CCCCCCCCCCC
- Molecular Weight1
- 380.73
- 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 | 1.0534 | Relay (... Calculated Property | |
| ΔfG° | 174.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -603.13 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 62.16 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 130.19 | kJ/mol | Relay (... Calculated Property |
| IE | 9.87 | eV | Relay (... Calculated Property |
| log10WS | -10.40 | Relay (... Calculated Property | |
| logPoct/wat | 10.635 | Crippen Calculated Property | |
| McVol | 391.290 | ml/mol | McGowan Calculated Property |
| Pc | 691.79 | kPa | Joback Calculated Property |
| Inp | [2607.00; 2607.00] |
|
|
| Inp | 2607.00 | NIST | |
| Inp | 2607.00 | NIST | |
| Tboil | 623.70 | K | Relay (... Calculated Property |
| Tc | 795.06 | K | Relay (... Calculated Property |
| Tfus | 279.52 | K | Relay (... Calculated Property |
| Vc | 1.528 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1282.19; 1412.85] | J/mol×K | [816.72; 1000.04] |
|
| Cp,gas | 1282.19 | J/mol×K | 816.72 | Joback Calculated Property |
| Cp,gas | 1306.88 | J/mol×K | 847.27 | Joback Calculated Property |
| Cp,gas | 1330.33 | J/mol×K | 877.83 | Joback Calculated Property |
| Cp,gas | 1352.60 | J/mol×K | 908.38 | Joback Calculated Property |
| Cp,gas | 1373.74 | J/mol×K | 938.93 | Joback Calculated Property |
| Cp,gas | 1393.80 | J/mol×K | 969.49 | Joback Calculated Property |
| Cp,gas | 1412.85 | J/mol×K | 1000.04 | Joback Calculated Property |
| η | [0.0000347; 0.0020683] | Pa×s | [379.05; 816.72] |
|
| η | 0.0020683 | Pa×s | 379.05 | Joback Calculated Property |
| η | 0.0006041 | Pa×s | 451.99 | Joback Calculated Property |
| η | 0.0002484 | Pa×s | 524.94 | Joback Calculated Property |
| η | 0.0001269 | Pa×s | 597.88 | Joback Calculated Property |
| η | 0.0000750 | Pa×s | 670.83 | Joback Calculated Property |
| η | 0.0000492 | Pa×s | 743.77 | Joback Calculated Property |
| η | 0.0000347 | Pa×s | 816.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexadecane, 3-undecyl.
Sources
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