- InChI
- InChI=1S/C16H26/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3,6,8,12-15H,1,4-5,7,9-11,16H2,2H3/b8-6+,14-12+,15-13+
- InChI Key
- YKFPTPBZTVYMMC-POIBZBIISA-N
- Formula
- C16H26
- SMILES
- C=CCCCCC=CCC=CCC=CCC
- Molecular Weight1
- 218.38
- 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.
- 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 |
|---|---|---|---|
| ω | 0.4182 | Relay (1.0) Calculated Property | |
| ΔfG° | 412.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -77.96 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.68 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.61 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.01 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.592 | Crippen Calculated Property | |
| McVol | 219.100 | ml/mol | McGowan Calculated Property |
| Pc | 1530.66 | kPa | Joback Calculated Property |
| Inp | 1561.00 | NIST | |
| I | [1769.00; 1769.00] |
|
|
| I | 1769.00 | NIST | |
| I | 1769.00 | NIST | |
| Tboil | 535.88 | K | Relay (1.0) Calculated Property |
| Tc | 702.89 | K | Relay (1.0) Calculated Property |
| Tfus | 241.00 | K | Relay (1.0) Calculated Property |
| Vc | 0.763 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [535.72; 630.16] | J/mol×K | [574.84; 754.57] |
|
| Cp,gas | 535.72 | J/mol×K | 574.84 | Joback Calculated Property |
| Cp,gas | 553.55 | J/mol×K | 604.79 | Joback Calculated Property |
| Cp,gas | 570.47 | J/mol×K | 634.75 | Joback Calculated Property |
| Cp,gas | 586.54 | J/mol×K | 664.70 | Joback Calculated Property |
| Cp,gas | 601.80 | J/mol×K | 694.66 | Joback Calculated Property |
| Cp,gas | 616.33 | J/mol×K | 724.61 | Joback Calculated Property |
| Cp,gas | 630.16 | J/mol×K | 754.57 | Joback Calculated Property |
| η | [0.0000973; 0.0040046] | Pa×s | [253.08; 574.84] |
|
| η | 0.0040046 | Pa×s | 253.08 | Joback Calculated Property |
| η | 0.0012541 | Pa×s | 306.71 | Joback Calculated Property |
| η | 0.0005548 | Pa×s | 360.33 | Joback Calculated Property |
| η | 0.0003032 | Pa×s | 413.96 | Joback Calculated Property |
| η | 0.0001904 | Pa×s | 467.59 | Joback Calculated Property |
| η | 0.0001315 | Pa×s | 521.21 | Joback Calculated Property |
| η | 0.0000973 | Pa×s | 574.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,7,10,13-Hexadecatetraene.
Sources
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