- InChI
- InChI=1S/C12H18/c1-3-5-7-9-11-12-10-8-6-4-2/h7-12H2,1-2H3
- InChI Key
- CNMHMGNWEVHOCK-UHFFFAOYSA-N
- Formula
- C12H18
- SMILES
- CC#CCCCCCCC#CC
- Molecular Weight1
- 162.27
- CAS
- 31699-38-4
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.3969 | Relay (1.0) Calculated Property | |
| ΔfG° | 455.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 188.81 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.68 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.92 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.37 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.374 | Crippen Calculated Property | |
| McVol | 162.740 | ml/mol | McGowan Calculated Property |
| Pc | 2379.54 | kPa | Joback Calculated Property |
| Tboil | 484.16 | K | Relay (1.0) Calculated Property |
| Tc | 698.23 | K | Relay (1.0) Calculated Property |
| Tfus | 296.26 | K | Relay (1.0) Calculated Property |
| Vc | 0.590 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [345.46; 429.75] | J/mol×K | [491.96; 696.84] | 
|
| Cp,gas | 345.46 | J/mol×K | 491.96 | Joback Calculated Property |
| Cp,gas | 361.21 | J/mol×K | 526.11 | Joback Calculated Property |
| Cp,gas | 376.24 | J/mol×K | 560.25 | Joback Calculated Property |
| Cp,gas | 390.60 | J/mol×K | 594.40 | Joback Calculated Property |
| Cp,gas | 404.28 | J/mol×K | 628.55 | Joback Calculated Property |
| Cp,gas | 417.33 | J/mol×K | 662.70 | Joback Calculated Property |
| Cp,gas | 429.75 | J/mol×K | 696.84 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 377.00 | K | 1.00 | NIST |
Similar Compounds
Find more compounds similar to 2,10-Dodecadiyne.
Sources
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