- InChI
- InChI=1S/C4H11NO/c1-4(5)3-6-2/h4H,3,5H2,1-2H3
- InChI Key
- NXMXETCTWNXSFG-UHFFFAOYSA-N
- Formula
- C4H11NO
- SMILES
- COCC(C)N
- Molecular Weight1
- 89.14
- CAS
- 37143-54-7
- Other Names
-
- (.+/-.)-2-Amino-1-methoxypropane
- 1-Methoxy-2-propanamine
- Ethylamine, 2-methoxy-1-methyl-
- 1-Methoxy-2-propylamine
- 2-amino-1-methoxypropane
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -226.21 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 8.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 36.15 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.96 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | -0.020 | Crippen Calculated Property | |
| McVol | 83.070 | ml/mol | McGowan Calculated Property |
| Pc | 4140.93 | kPa | Joback Calculated Property |
| Tboil | 368.35 | K | Relay (1.0) Calculated Property |
| Tc | 540.27 | K | Relay (1.0) Calculated Property |
| Tfus | 198.37 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 366.20 | K | 99.10 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [125.80; 280.70] | 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 | 2.95610e+01 | |||
| Coefficient B | 3.88440e-01 | |||
| Coefficient C | -1.29400e-04 | |||
| Coefficient D | -7.90000e-09 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 125.80 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 150.44 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 173.28 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 194.29 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 213.46 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 230.75 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 246.15 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 259.62 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 271.15 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 280.70 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Propanamine, 1-methoxy-.
Sources
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