- InChI
- InChI=1S/C3H7/c1-3-2/h1,3H2,2H3
- InChI Key
- OCBFFGCSTGGPSQ-UHFFFAOYSA-N
- Formula
- C3H7
- SMILES
- [CH2]CC
- Molecular Weight1
- 43.09
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- EA : Electron affinity (eV).
- 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 | 0.2121 | Relay (1.0) Calculated Property | |
| EA | -0.07 ± 0.12 | eV | NIST |
| ΔfG° | 26.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 100.00 ± 2.00 | kJ/mol | NIST |
| ΔfusH° | 5.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 14.12 | kJ/mol | Relay (1.0) Calculated Property |
| IE | [8.09; 8.43] | eV |
|
| IE | 8.09 ± 0.01 | eV | NIST |
| IE | 8.15 ± 0.02 | eV | NIST |
| IE | 8.10 ± 0.05 | eV | NIST |
| IE | 8.13 ± 0.05 | eV | NIST |
| IE | 8.20 ± 0.10 | eV | NIST |
| IE | 8.10 | eV | NIST |
| IE | 8.35 ± 0.01 | eV | NIST |
| IE | 8.43 ± 0.02 | eV | NIST |
| log10WS | -1.49 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.230 | Crippen Calculated Property | |
| McVol | 50.980 | ml/mol | McGowan Calculated Property |
| Pc | 4678.49 | kPa | Joback Calculated Property |
| Tboil | 247.55 | K | Relay (1.0) Calculated Property |
| Tc | 375.90 | K | Relay (1.0) Calculated Property |
| Tfus | 93.94 | K | Relay (1.0) Calculated Property |
| Vc | 0.194 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [63.61; 157.97] | 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 | -2.02480e+01 | |||
| Coefficient B | 3.91920e-01 | |||
| Coefficient C | -3.46800e-04 | |||
| Coefficient D | 1.33100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 63.61 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 80.89 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 95.50 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 107.84 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 118.34 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 127.42 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 135.50 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 143.01 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 150.36 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 157.97 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0001909; 0.0001130] | Pa×s | [139.94; 296.61] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -9.55573e+00 | |||
| Coefficient B | 1.38790e+02 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 139.94 | |||
| Temperature range, max. | 296.61 | |||
| η | 0.0001909 | Pa×s | 139.94 | Calculated Property |
| η | 0.0001710 | Pa×s | 157.35 | Calculated Property |
| η | 0.0001566 | Pa×s | 174.76 | Calculated Property |
| η | 0.0001458 | Pa×s | 192.16 | Calculated Property |
| η | 0.0001373 | Pa×s | 209.57 | Calculated Property |
| η | 0.0001305 | Pa×s | 226.98 | Calculated Property |
| η | 0.0001249 | Pa×s | 244.39 | Calculated Property |
| η | 0.0001203 | Pa×s | 261.80 | Calculated Property |
| η | 0.0001164 | Pa×s | 279.20 | Calculated Property |
| η | 0.0001130 | Pa×s | 296.61 | Calculated Property |
Similar Compounds
Find more compounds similar to n-Propyl radical.
Sources
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