- InChI
- InChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-6,9-16H2,1H3
- InChI Key
- BBJUQSUKHMQMSH-UHFFFAOYSA-N
- Formula
- C16H30O
- SMILES
- CCCCCCC#CCCCCCCCCO
- Molecular Weight1
- 238.41
- CAS
- 88109-73-3
- 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 | 0.8752 | Relay (... Calculated Property | |
| ΔfG° | 149.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -278.90 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 44.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.05 | kJ/mol | Relay (... Calculated Property |
| IE | 9.47 | eV | Relay (... Calculated Property |
| log10WS | -5.18 | Relay (... Calculated Property | |
| logPoct/wat | 4.683 | Crippen Calculated Property | |
| McVol | 233.570 | ml/mol | McGowan Calculated Property |
| Pc | 1597.44 | kPa | Joback Calculated Property |
| Tboil | 580.17 | K | Relay (... Calculated Property |
| Tc | 777.43 | K | Relay (... Calculated Property |
| Tfus | 308.10 | K | Relay (... Calculated Property |
| Vc | 0.873 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [650.81; 738.63] | J/mol×K | [666.66; 837.62] | 
|
| Cp,gas | 650.81 | J/mol×K | 666.66 | Joback Calculated Property |
| Cp,gas | 667.14 | J/mol×K | 695.15 | Joback Calculated Property |
| Cp,gas | 682.75 | J/mol×K | 723.65 | Joback Calculated Property |
| Cp,gas | 697.69 | J/mol×K | 752.14 | Joback Calculated Property |
| Cp,gas | 711.97 | J/mol×K | 780.63 | Joback Calculated Property |
| Cp,gas | 725.61 | J/mol×K | 809.13 | Joback Calculated Property |
| Cp,gas | 738.63 | J/mol×K | 837.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 9-Hexadecyn-1-ol.
Sources
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