- InChI
- InChI=1S/C13H24/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-4H,1-2,5-13H2
- InChI Key
- BPHFKBMQSYYNGQ-UHFFFAOYSA-N
- Formula
- C13H24
- SMILES
- C=CCCCCCCCCCC=C
- Molecular Weight1
- 180.33
- CAS
- 21964-48-7
- Other Names
-
- Tridecadiene-1,12
- 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.
- Ip : 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 | 0.5580 | Relay (1.0) Calculated Property | |
| ΔfG° | 234.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -117.29 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.90 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.24 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.00 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.869 | Crippen Calculated Property | |
| McVol | 185.430 | ml/mol | McGowan Calculated Property |
| Pc | 1762.45 | kPa | Joback Calculated Property |
| Inp | [1271.00; 1279.00] |
|
|
| Inp | 1271.00 | NIST | |
| Inp | 1279.00 | NIST | |
| Inp | 1279.00 | NIST | |
| Ip | [1434.00; 1494.00] |
|
|
| Ip | 1434.00 | NIST | |
| Ip | 1494.00 | NIST | |
| Ip | 1434.00 | NIST | |
| Tboil | 498.23 | K | Relay (1.0) Calculated Property |
| Tc | 679.02 | K | Relay (1.0) Calculated Property |
| Tfus | 257.52 | K | Relay (1.0) Calculated Property |
| Vc | 0.703 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [261.64; 632.99] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -1.49110e+01 | |||
| Coefficient B | 1.19880e+00 | |||
| Coefficient C | -7.29200e-04 | |||
| Coefficient D | 1.78300e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 261.64 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 325.83 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 382.96 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 433.62 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 478.36 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 517.74 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 552.33 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 582.69 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 609.39 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 632.99 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0048581; 0.0002475] | Pa×s | [232.75; 459.48] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.13602e+01 | |||
| Coefficient B | 1.40420e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 232.75 | |||
| Temperature range, max. | 459.48 | |||
| η | 0.0048581 | Pa×s | 232.75 | Calculated Property |
| η | 0.0026951 | Pa×s | 257.94 | Calculated Property |
| η | 0.0016604 | Pa×s | 283.13 | Calculated Property |
| η | 0.0011072 | Pa×s | 308.33 | Calculated Property |
| η | 0.0007849 | Pa×s | 333.52 | Calculated Property |
| η | 0.0005840 | Pa×s | 358.71 | Calculated Property |
| η | 0.0004517 | Pa×s | 383.90 | Calculated Property |
| η | 0.0003606 | Pa×s | 409.09 | Calculated Property |
| η | 0.0002955 | Pa×s | 434.29 | Calculated Property |
| η | 0.0002475 | Pa×s | 459.48 | Calculated Property |
Similar Compounds
Find more compounds similar to 1,12-Tridecadiene.
Sources
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