- InChI
- InChI=1S/C16H30/c1-15(2)11-9-7-5-6-8-10-12-16(3,4)14-13-15/h5-6H,7-14H2,1-4H3/b6-5+
- InChI Key
- FKGCSZKVSMEKRA-AATRIKPKSA-N
- Formula
- C16H30
- SMILES
- CC1(C)CCCC=CCCCC(C)(C)CC1
- Molecular Weight1
- 222.41
- CAS
- 15811-94-6
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 | 0.2787 | Relay (1.0) Calculated Property | |
| ΔfG° | 46.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -301.75 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 6.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.32 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.63 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.12 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.729 | Crippen Calculated Property | |
| McVol | 221.140 | ml/mol | McGowan Calculated Property |
| Pc | 1880.53 | kPa | Joback Calculated Property |
| Tboil | 561.34 | K | Relay (1.0) Calculated Property |
| Tc | 726.98 | K | Relay (1.0) Calculated Property |
| Tfus | 326.06 | K | Relay (1.0) Calculated Property |
| Vc | 0.746 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [596.63; 748.88] | J/mol×K | [605.62; 848.72] | 
|
| Cp,gas | 596.63 | J/mol×K | 605.62 | Joback Calculated Property |
| Cp,gas | 625.50 | J/mol×K | 646.14 | Joback Calculated Property |
| Cp,gas | 652.66 | J/mol×K | 686.65 | Joback Calculated Property |
| Cp,gas | 678.34 | J/mol×K | 727.17 | Joback Calculated Property |
| Cp,gas | 702.79 | J/mol×K | 767.68 | Joback Calculated Property |
| Cp,gas | 726.22 | J/mol×K | 808.20 | Joback Calculated Property |
| Cp,gas | 748.88 | J/mol×K | 848.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-1,1,4,4-Tetramethylcyclododec-8-ene.
Sources
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