- InChI
- InChI=1S/C15H25NO/c1-4-5-6-7-8-9-10-11-12-14-16-15(2,3)13-17-14/h1H,5-13H2,2-3H3
- InChI Key
- SIHYNDGTPLKOGL-UHFFFAOYSA-N
- Formula
- C15H25NO
- SMILES
- C#CCCCCCCCCC1=NC(C)(C)CO1
- Molecular Weight1
- 235.37
- 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.
- 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 | 0.5862 | Relay (1.0) Calculated Property | |
| ΔfG° | 380.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -155.88 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.73 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.69 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.948 | Crippen Calculated Property | |
| McVol | 214.300 | ml/mol | McGowan Calculated Property |
| Pc | 1937.24 | kPa | Joback Calculated Property |
| Inp | 1637.80 | NIST | |
| Tboil | 564.54 | K | Relay (1.0) Calculated Property |
| Tc | 772.70 | K | Relay (1.0) Calculated Property |
| Tfus | 294.80 | K | Relay (1.0) Calculated Property |
| Vc | 0.791 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [595.43; 698.58] | J/mol×K | [633.03; 840.12] | 
|
| Cp,gas | 595.43 | J/mol×K | 633.03 | Joback Calculated Property |
| Cp,gas | 614.72 | J/mol×K | 667.54 | Joback Calculated Property |
| Cp,gas | 633.03 | J/mol×K | 702.06 | Joback Calculated Property |
| Cp,gas | 650.47 | J/mol×K | 736.57 | Joback Calculated Property |
| Cp,gas | 667.13 | J/mol×K | 771.09 | Joback Calculated Property |
| Cp,gas | 683.13 | J/mol×K | 805.60 | Joback Calculated Property |
| Cp,gas | 698.58 | J/mol×K | 840.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 10-Undecynoic acid, 4,4-dimethyloxazoline (dmox) derivative.
Sources
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