- InChI
- InChI=1S/C12H25NO3/c1-3-4-5-6-7-8-9-10-11-12(2)16-13(14)15/h12H,3-11H2,1-2H3
- InChI Key
- TZINGABWMPNNOT-UHFFFAOYSA-N
- Formula
- C12H25NO3
- SMILES
- CCCCCCCCCCC(C)O[N+](=O)[O-]
- Molecular Weight1
- 231.33
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -21.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -439.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.92 | kJ/mol | Joback Calculated Property |
| log10WS | -5.12 | Crippen Calculated Property | |
| logPoct/wat | 4.114 | Crippen Calculated Property | |
| McVol | 203.230 | ml/mol | McGowan Calculated Property |
| Pc | 1784.86 | kPa | Joback Calculated Property |
| Inp | 1554.00 | NIST | |
| Tboil | 647.78 | K | Joback Calculated Property |
| Tc | 837.11 | K | Joback Calculated Property |
| Tfus | 375.84 | K | Joback Calculated Property |
| Vc | 0.801 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [564.01; 650.22] | J/mol×K | [647.78; 837.11] | 
|
| Cp,gas | 564.01 | J/mol×K | 647.78 | Joback Calculated Property |
| Cp,gas | 580.33 | J/mol×K | 679.33 | Joback Calculated Property |
| Cp,gas | 595.84 | J/mol×K | 710.89 | Joback Calculated Property |
| Cp,gas | 610.57 | J/mol×K | 742.44 | Joback Calculated Property |
| Cp,gas | 624.53 | J/mol×K | 774.00 | Joback Calculated Property |
| Cp,gas | 637.74 | J/mol×K | 805.55 | Joback Calculated Property |
| Cp,gas | 650.22 | J/mol×K | 837.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Dodecyl nitrate.
Sources
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