- InChI
- InChI=1S/C14H26/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-7,9,11-14H2,1-2H3
- InChI Key
- QWZXVDGVISCHQH-UHFFFAOYSA-N
- Formula
- C14H26
- SMILES
- CCCC#CCCCCCCCCC
- Molecular Weight1
- 194.36
- CAS
- 60212-33-1
- Other Names
-
- 4-C14H26
- 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).
- Inp : Non-polar retention indices.
- I : 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 | 0.5427 | Relay (1.0) Calculated Property | |
| ΔfG° | 269.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -60.09 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 35.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.93 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.11 ± 0.03 | eV | NIST |
| log10WS | -6.19 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.931 | Crippen Calculated Property | |
| McVol | 199.520 | ml/mol | McGowan Calculated Property |
| Pc | 1733.22 | kPa | Joback Calculated Property |
| Inp | [1406.00; 1427.00] |
|
|
| Inp | 1427.00 | NIST | |
| Inp | 1407.00 | NIST | |
| Inp | 1406.00 | NIST | |
| Inp | 1407.00 | NIST | |
| I | [1553.60; 1586.00] |
|
|
| I | 1557.80 | NIST | |
| I | 1576.00 | NIST | |
| I | 1576.30 | NIST | |
| I | 1584.00 | NIST | |
| I | 1585.00 | NIST | |
| I | 1586.00 | NIST | |
| I | 1586.00 | NIST | |
| I | 1586.00 | NIST | |
| I | 1553.60 | NIST | |
| I | 1557.80 | NIST | |
| I | 1576.00 | NIST | |
| Tboil | 503.90 | K | Relay (1.0) Calculated Property |
| Tc | 700.22 | K | Relay (1.0) Calculated Property |
| Tfus | 251.29 | K | Relay (1.0) Calculated Property |
| Vc | 0.772 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [473.12; 569.28] | J/mol×K | [528.72; 706.35] |
|
| Cp,gas | 473.12 | J/mol×K | 528.72 | Joback Calculated Property |
| Cp,gas | 490.92 | J/mol×K | 558.32 | Joback Calculated Property |
| Cp,gas | 507.98 | J/mol×K | 587.93 | Joback Calculated Property |
| Cp,gas | 524.33 | J/mol×K | 617.53 | Joback Calculated Property |
| Cp,gas | 539.98 | J/mol×K | 647.14 | Joback Calculated Property |
| Cp,gas | 554.96 | J/mol×K | 676.74 | Joback Calculated Property |
| Cp,gas | 569.28 | J/mol×K | 706.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Tetradecyne.
Sources
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