- InChI
- InChI=1S/C13H27N/c1-12(2,3)10-8-7-9-11(14-10)13(4,5)6/h10-11,14H,7-9H2,1-6H3
- InChI Key
- ZOYHTWUFFGGARK-UHFFFAOYSA-N
- Formula
- C13H27N
- SMILES
- CC(C)(C)C1CCCC(C(C)(C)C)N1
- Molecular Weight1
- 197.36
- CAS
- 66922-18-7
- ω : Acentric Factor.
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (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).
- 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).
- 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 | 0.3937 | Relay (1.0) Calculated Property | |
| PAff | 992.50 | kJ/mol | NIST |
| BasG | 960.10 | kJ/mol | NIST |
| ΔfG° | 168.71 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -247.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.16 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.69 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.86 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.589 | Crippen Calculated Property | |
| McVol | 193.150 | ml/mol | McGowan Calculated Property |
| Pc | 2009.10 | kPa | Joback Calculated Property |
| Tboil | 505.79 | K | Relay (1.0) Calculated Property |
| Tc | 720.76 | K | Relay (1.0) Calculated Property |
| Tfus | 318.67 | K | Relay (1.0) Calculated Property |
| Vc | 0.679 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [506.17; 631.35] | J/mol×K | [553.81; 773.20] | 
|
| Cp,gas | 506.17 | J/mol×K | 553.81 | Joback Calculated Property |
| Cp,gas | 530.64 | J/mol×K | 590.38 | Joback Calculated Property |
| Cp,gas | 553.58 | J/mol×K | 626.94 | Joback Calculated Property |
| Cp,gas | 575.05 | J/mol×K | 663.51 | Joback Calculated Property |
| Cp,gas | 595.12 | J/mol×K | 700.07 | Joback Calculated Property |
| Cp,gas | 613.87 | J/mol×K | 736.64 | Joback Calculated Property |
| Cp,gas | 631.35 | J/mol×K | 773.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,6-Di-t-butylpiperidine.
Sources
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