- InChI
- InChI=1S/C6H12N2/c7-5-3-1-2-4-6-8/h1-5,7H2
- InChI Key
- KBMSFJFLSXLIDJ-UHFFFAOYSA-N
- Formula
- C6H12N2
- SMILES
- N#CCCCCCN
- Molecular Weight1
- 112.17
- CAS
- 2432-74-8
- Other Names
-
- «omega»-Aminocapronitrile
- 6-Aminocapronitrile
- 6-Aminohexanenitrile
- 6-aminohexanonitrile
- 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).
- Tboilr : Boiling point at reduced pressure (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° | 199.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 31.50 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.07 | kJ/mol | Joback Calculated Property |
| log10WS | -1.63 | Crippen Calculated Property | |
| logPoct/wat | 1.029 | Crippen Calculated Property | |
| McVol | 106.760 | ml/mol | McGowan Calculated Property |
| Pc | 3220.98 | kPa | Joback Calculated Property |
| Tboil | 511.29 | K | Joback Calculated Property |
| Tc | 711.96 | K | Joback Calculated Property |
| Tfus | 305.63 | K | Joback Calculated Property |
| Vc | 0.426 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [238.94; 290.85] | J/mol×K | [511.29; 711.96] | 
|
| Cp,gas | 238.94 | J/mol×K | 511.29 | Joback Calculated Property |
| Cp,gas | 248.71 | J/mol×K | 544.73 | Joback Calculated Property |
| Cp,gas | 258.02 | J/mol×K | 578.18 | Joback Calculated Property |
| Cp,gas | 266.87 | J/mol×K | 611.62 | Joback Calculated Property |
| Cp,gas | 275.28 | J/mol×K | 645.07 | Joback Calculated Property |
| Cp,gas | 283.27 | J/mol×K | 678.51 | Joback Calculated Property |
| Cp,gas | 290.85 | J/mol×K | 711.96 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 401.20 | K | 3.60 | NIST |
Similar Compounds
Find more compounds similar to Hexanenitrile, 6-amino-.
Sources
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