- InChI
- InChI=1S/C16H30O2/c1-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16(17)18-15/h15H,2-14H2,1H3
- InChI Key
- GILZFLFJYUGJLX-UHFFFAOYSA-N
- Formula
- C16H30O2
- SMILES
- CC1CCCCCCCCCCCCCC(=O)O1
- Molecular Weight1
- 254.41
- CAS
- 4459-57-8
- Other Names
-
- 15-Hexadecanolide
- (+/-)-15-Hexadecanolide
- (+-)-15-hexadecanolide
- 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 | 0.3656 | Relay (... Calculated Property | |
| ΔfG° | -221.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -685.06 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 15.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.34 | kJ/mol | Relay (... Calculated Property |
| IE | 9.48 | eV | Relay (... Calculated Property |
| log10WS | -4.34 | Relay (... Calculated Property | |
| logPoct/wat | 5.003 | Crippen Calculated Property | |
| McVol | 232.880 | ml/mol | McGowan Calculated Property |
| Pc | 1935.54 | kPa | Joback Calculated Property |
| Inp | [1943.00; 1959.00] |
|
|
| Inp | 1943.00 | NIST | |
| Inp | 1959.00 | NIST | |
| I | [2260.00; 2304.00] |
|
|
| I | 2304.00 | NIST | |
| I | 2260.00 | NIST | |
| I | 2260.00 | NIST | |
| I | 2260.00 | NIST | |
| I | 2260.00 | NIST | |
| Tboil | 665.58 | K | Relay (... Calculated Property |
| Tc | 838.73 | K | Relay (... Calculated Property |
| Tfus | 318.23 | K | Relay (... Calculated Property |
| Vc | 0.761 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [726.50; 861.88] | J/mol×K | [722.50; 984.52] |
|
| Cp,gas | 726.50 | J/mol×K | 722.50 | Joback Calculated Property |
| Cp,gas | 756.49 | J/mol×K | 766.17 | Joback Calculated Property |
| Cp,gas | 783.67 | J/mol×K | 809.84 | Joback Calculated Property |
| Cp,gas | 807.91 | J/mol×K | 853.51 | Joback Calculated Property |
| Cp,gas | 829.10 | J/mol×K | 897.18 | Joback Calculated Property |
| Cp,gas | 847.13 | J/mol×K | 940.85 | Joback Calculated Property |
| Cp,gas | 861.88 | J/mol×K | 984.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Oxacyclohexadecan-2-one, 16-methyl-.
Sources
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