- InChI
- InChI=1S/C13H27NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-14(15)16/h2-13H2,1H3
- InChI Key
- DMUORYXPGSLKKV-UHFFFAOYSA-N
- Formula
- C13H27NO3
- SMILES
- CCCCCCCCCCCCCO[N+](=O)[O-]
- Molecular Weight1
- 245.36
- 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° | -10.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -454.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.53 | kJ/mol | Joback Calculated Property |
| log10WS | -5.43 | Crippen Calculated Property | |
| logPoct/wat | 4.506 | Crippen Calculated Property | |
| McVol | 217.320 | ml/mol | McGowan Calculated Property |
| Pc | 1637.78 | kPa | Joback Calculated Property |
| Inp | 1717.00 | NIST | |
| Tboil | 671.10 | K | Joback Calculated Property |
| Tc | 855.99 | K | Joback Calculated Property |
| Tfus | 402.11 | K | Joback Calculated Property |
| Vc | 0.864 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [617.39; 704.63] | J/mol×K | [671.10; 855.99] | 
|
| Cp,gas | 617.39 | J/mol×K | 671.10 | Joback Calculated Property |
| Cp,gas | 633.87 | J/mol×K | 701.91 | Joback Calculated Property |
| Cp,gas | 649.55 | J/mol×K | 732.73 | Joback Calculated Property |
| Cp,gas | 664.45 | J/mol×K | 763.54 | Joback Calculated Property |
| Cp,gas | 678.58 | J/mol×K | 794.36 | Joback Calculated Property |
| Cp,gas | 691.97 | J/mol×K | 825.17 | Joback Calculated Property |
| Cp,gas | 704.63 | J/mol×K | 855.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Tridecyl nitrate.
Sources
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