- InChI
- InChI=1S/C12H20/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-2,7,9H,3-6,8,10-12H2/b2-1-,9-7+
- InChI Key
- KEMUGHMYINTXKW-UYIJSCIWSA-N
- Formula
- C12H20
- SMILES
- C1=CCCCCCCC=CCC1
- Molecular Weight1
- 164.29
- CAS
- 19428-99-0
- Other Names
-
- trans,cis-1,5-Cyclododecadiene
- (E,Z)-1,5-Cyclododecadiene
- c,t-Cyclododeca-1,5-diene
- cis,trans-1,5-Cyclododecadiene
- 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 | 0.1755 | Relay (1.0) Calculated Property | |
| ΔfG° | 69.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -81.37 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 7.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.51 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.233 | Crippen Calculated Property | |
| McVol | 160.480 | ml/mol | McGowan Calculated Property |
| Pc | 2741.15 | kPa | Joback Calculated Property |
| Inp | [1346.00; 1364.00] |
|
|
| Inp | 1346.00 | NIST | |
| Inp | 1356.00 | NIST | |
| Inp | 1364.00 | NIST | |
| Tboil | 513.50 | K | Relay (1.0) Calculated Property |
| Tc | 693.83 | K | Relay (1.0) Calculated Property |
| Tfus | 256.56 | K | Relay (1.0) Calculated Property |
| Vc | 0.526 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [177.36; 564.91] | 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 | -9.47300e+01 | |||
| Coefficient B | 1.12280e+00 | |||
| Coefficient C | -4.61560e-04 | |||
| Coefficient D | -1.60000e-09 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 177.36 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 244.65 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 305.90 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 361.09 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 410.23 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 453.31 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 490.32 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 521.26 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 546.13 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 564.91 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.1459004; 0.0000504] | Pa×s | [217.02; 537.58] |
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 | -1.52924e+01 | |||
| Coefficient B | 2.90102e+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. | 217.02 | |||
| Temperature range, max. | 537.58 | |||
| η | 0.1459004 | Pa×s | 217.02 | Calculated Property |
| η | 0.0221606 | Pa×s | 252.64 | Calculated Property |
| η | 0.0053626 | Pa×s | 288.26 | Calculated Property |
| η | 0.0017730 | Pa×s | 323.87 | Calculated Property |
| η | 0.0007299 | Pa×s | 359.49 | Calculated Property |
| η | 0.0003526 | Pa×s | 395.11 | Calculated Property |
| η | 0.0001922 | Pa×s | 430.73 | Calculated Property |
| η | 0.0001149 | Pa×s | 466.35 | Calculated Property |
| η | 0.0000739 | Pa×s | 501.96 | Calculated Property |
| η | 0.0000504 | Pa×s | 537.58 | Calculated Property |
Similar Compounds
Find more compounds similar to 1,5-Cyclododecadiene, (E,Z)-.
Sources
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