- InChI
- InChI=1S/C8H18N2O2/c1-3-5-7-9(10(11)12)8-6-4-2/h3-8H2,1-2H3
- InChI Key
- IBFAEPSQNZNTBK-UHFFFAOYSA-N
- Formula
- C8H18N2O2
- SMILES
- CCCCN(CCCC)[N+](=O)[O-]
- Molecular Weight1
- 174.24
- CAS
- 4164-31-2
- Other Names
-
- Dibutylamine, N-nitro-
- Dibutylnitramine
- N-Nitrodibutylamine
- Di-n-butylnitramine
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- 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 |
|---|---|---|---|
| ΔcH°liquid | -5510.70 | kJ/mol | NIST |
| ΔfG° | 162.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -151.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.04 | kJ/mol | Joback Calculated Property |
| log10WS | -2.82 | Crippen Calculated Property | |
| logPoct/wat | 2.080 | Crippen Calculated Property | |
| McVol | 150.980 | ml/mol | McGowan Calculated Property |
| Pc | 2561.10 | kPa | Joback Calculated Property |
| Tboil | 546.72 | K | Joback Calculated Property |
| Tc | 740.57 | K | Joback Calculated Property |
| Tfus | 356.00 | K | Joback Calculated Property |
| Vc | 0.584 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [373.10; 448.40] | J/mol×K | [546.72; 740.57] | 
|
| Cp,gas | 373.10 | J/mol×K | 546.72 | Joback Calculated Property |
| Cp,gas | 387.42 | J/mol×K | 579.03 | Joback Calculated Property |
| Cp,gas | 400.99 | J/mol×K | 611.34 | Joback Calculated Property |
| Cp,gas | 413.85 | J/mol×K | 643.65 | Joback Calculated Property |
| Cp,gas | 426.02 | J/mol×K | 675.96 | Joback Calculated Property |
| Cp,gas | 437.52 | J/mol×K | 708.27 | Joback Calculated Property |
| Cp,gas | 448.40 | J/mol×K | 740.57 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Butanamine, N-butyl-N-nitro-.
Sources
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