- InChI
- InChI=1S/C6H15N/c1-6(2,3)4-5-7/h4-5,7H2,1-3H3
- InChI Key
- GPWHFPWZAPOYNO-UHFFFAOYSA-N
- Formula
- C6H15N
- SMILES
- CC(C)(C)CCN
- Molecular Weight1
- 101.19
- Other Names
-
- 1-Butanamine, 3,3-dimethyl-
- ω : Acentric Factor.
- 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 | 0.3722 | Relay (1.0) Calculated Property | |
| ΔfG° | 68.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -178.63 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 9.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.48 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.81 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.19 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.381 | Crippen Calculated Property | |
| McVol | 105.380 | ml/mol | McGowan Calculated Property |
| Pc | 3388.08 | kPa | Joback Calculated Property |
| Tboil | 388.20 | K | NIST |
| Tc | 564.07 | K | Relay (1.0) Calculated Property |
| Tfus | 240.75 | K | Relay (1.0) Calculated Property |
| Vc | 0.359 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [151.68; 366.31] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -2.05480e+01 | |||
| Coefficient B | 7.61560e-01 | |||
| Coefficient C | -5.17800e-04 | |||
| Coefficient D | 1.43100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 151.68 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 190.40 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 224.35 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 253.98 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 279.74 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 302.08 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 321.45 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 338.32 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 353.12 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 366.31 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to 3,3-DIMETHYLBUTYLAMINE.
Sources
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