- InChI
- InChI=1S/C7H14/c1-2-3-4-7-5-6-7/h7H,2-6H2,1H3
- InChI Key
- SXZVSSJONMPJMN-UHFFFAOYSA-N
- Formula
- C7H14
- SMILES
- CCCCC1CC1
- Molecular Weight1
- 98.19
- CAS
- 930-57-4
- Other Names
-
- Butane, 1-cyclopropyl-
- Butylcyclopropane
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.3337 | Relay (1.0) Calculated Property | |
| ΔfG° | 68.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -81.84 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 36.51 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.46 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.53 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.587 | Crippen Calculated Property | |
| McVol | 98.630 | ml/mol | McGowan Calculated Property |
| Pc | 3228.31 | kPa | Joback Calculated Property |
| Inp | [712.00; 714.00] |
|
|
| Inp | 712.00 | NIST | |
| Inp | 714.00 | NIST | |
| Inp | 712.50 | NIST | |
| Inp | 713.70 | NIST | |
| Inp | 712.00 | NIST | |
| Inp | 712.00 | NIST | |
| Tboil | [371.15; 372.70] | K |
|
| Tboil | 371.15 ± 1.50 | K | NIST |
| Tboil | 372.70 ± 0.60 | K | NIST |
| Tboil | 372.70 ± 0.50 | K | NIST |
| Tc | 563.39 | K | Relay (1.0) Calculated Property |
| Tfus | [147.40; 148.50] | K |
|
| Tfus | 148.50 ± 0.50 | K | NIST |
| Tfus | 147.40 ± 0.50 | K | NIST |
| Vc | 0.381 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [130.54; 360.20] | 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 | -5.37170e+01 | |||
| Coefficient B | 8.19720e-01 | |||
| Coefficient C | -5.77200e-04 | |||
| Coefficient D | 1.71400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 130.54 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 171.63 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 207.56 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 238.88 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 266.13 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 289.84 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 310.56 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 328.83 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 345.20 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 360.20 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0020105; 0.0003077] | Pa×s | [147.95; 381.32] |
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 | -9.27611e+00 | |||
| Coefficient B | 4.53720e+02 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 147.95 | |||
| Temperature range, max. | 381.32 | |||
| η | 0.0020105 | Pa×s | 147.95 | Calculated Property |
| η | 0.0012726 | Pa×s | 173.88 | Calculated Property |
| η | 0.0009070 | Pa×s | 199.81 | Calculated Property |
| η | 0.0006988 | Pa×s | 225.74 | Calculated Property |
| η | 0.0005681 | Pa×s | 251.67 | Calculated Property |
| η | 0.0004800 | Pa×s | 277.60 | Calculated Property |
| η | 0.0004175 | Pa×s | 303.53 | Calculated Property |
| η | 0.0003711 | Pa×s | 329.46 | Calculated Property |
| η | 0.0003357 | Pa×s | 355.39 | Calculated Property |
| η | 0.0003077 | Pa×s | 381.32 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopropane, butyl-.
Sources
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