- InChI
- InChI=1S/C13H20/c1-13-11-9-7-5-3-2-4-6-8-10-12-13/h3,5-6,8,11H,2,4,7,9-10,12H2,1H3/b5-3-,8-6+,13-11-
- InChI Key
- VJHWJWRAAFGNQY-IQTUFHCISA-N
- Formula
- C13H20
- SMILES
- CC1=CCCC=CCCC=CCC1
- Molecular Weight1
- 176.30
- 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 | 0.1852 | Relay (... Calculated Property | |
| ΔfG° | 98.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -10.74 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 10.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.95 | kJ/mol | Relay (... Calculated Property |
| IE | 8.14 | eV | Relay (... Calculated Property |
| log10WS | -4.42 | Relay (... Calculated Property | |
| logPoct/wat | 4.399 | Crippen Calculated Property | |
| McVol | 170.270 | ml/mol | McGowan Calculated Property |
| Pc | 2537.93 | kPa | Joback Calculated Property |
| Inp | [1370.00; 1370.00] |
|
|
| Inp | 1370.00 | NIST | |
| Inp | 1370.00 | NIST | |
| Tboil | 525.48 | K | Relay (... Calculated Property |
| Tc | 690.35 | K | Relay (... Calculated Property |
| Tfus | 232.75 | K | Relay (... Calculated Property |
| Vc | 0.542 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [398.51; 521.25] | J/mol×K | [549.14; 793.41] |
|
| Cp,gas | 398.51 | J/mol×K | 549.14 | Joback Calculated Property |
| Cp,gas | 422.75 | J/mol×K | 589.85 | Joback Calculated Property |
| Cp,gas | 445.48 | J/mol×K | 630.56 | Joback Calculated Property |
| Cp,gas | 466.70 | J/mol×K | 671.27 | Joback Calculated Property |
| Cp,gas | 486.40 | J/mol×K | 711.99 | Joback Calculated Property |
| Cp,gas | 504.59 | J/mol×K | 752.70 | Joback Calculated Property |
| Cp,gas | 521.25 | J/mol×K | 793.41 | Joback Calculated Property |
| η | [0.0000478; 0.0352747] | Pa×s | [241.57; 549.14] |
|
| η | 0.0352747 | Pa×s | 241.57 | Joback Calculated Property |
| η | 0.0044782 | Pa×s | 292.83 | Joback Calculated Property |
| η | 0.0010515 | Pa×s | 344.09 | Joback Calculated Property |
| η | 0.0003595 | Pa×s | 395.36 | Joback Calculated Property |
| η | 0.0001573 | Pa×s | 446.62 | Joback Calculated Property |
| η | 0.0000816 | Pa×s | 497.88 | Joback Calculated Property |
| η | 0.0000478 | Pa×s | 549.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (Z,Z,E)-1,5,9-Cyclododecatriene, 1-methyl.
Sources
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