- InChI
- InChI=1S/C10H20/c1-4-5-8(2)6-10-7-9(10)3/h8-10H,4-7H2,1-3H3/t8?,9-,10-/m1/s1
- InChI Key
- HZFINUMNBBEFCF-VXRWAFEHSA-N
- Formula
- C10H20
- SMILES
- CCCC(C)CC1CC1C
- Molecular Weight1
- 140.27
- 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).
- 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 | 0.3921 | Relay (1.0) Calculated Property | |
| ΔfG° | 83.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -160.19 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.58 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 3.469 | Crippen Calculated Property | |
| McVol | 140.900 | ml/mol | McGowan Calculated Property |
| Pc | 2327.03 | kPa | Joback Calculated Property |
| Inp | [924.99; 930.01] |
|
|
| Inp | 928.02 | NIST | |
| Inp | 929.60 | NIST | |
| Inp | 930.01 | NIST | |
| Inp | 930.01 | NIST | |
| Inp | 924.99 | NIST | |
| Inp | 927.61 | NIST | |
| Inp | 925.98 | NIST | |
| Inp | 928.62 | NIST | |
| Tboil | 430.23 | K | Relay (1.0) Calculated Property |
| Tc | 620.15 | K | Relay (1.0) Calculated Property |
| Tfus | 161.81 | K | Relay (1.0) Calculated Property |
| Vc | 0.527 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Ionization energy, 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.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [196.13; 522.17] | 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 | -5.21870e+01 | |||
| Coefficient B | 1.08416e+00 | |||
| Coefficient C | -6.88200e-04 | |||
| Coefficient D | 1.78400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 196.13 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 253.13 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 303.62 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 348.17 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 387.33 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 421.68 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 451.77 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 478.18 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 501.45 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 522.17 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0014960; 0.0003757] | Pa×s | [201.16; 426.30] |
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 | -9.12143e+00 | |||
| Coefficient B | 5.26330e+02 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 201.16 | |||
| Temperature range, max. | 426.30 | |||
| η | 0.0014960 | Pa×s | 201.16 | Calculated Property |
| η | 0.0011201 | Pa×s | 226.18 | Calculated Property |
| η | 0.0008884 | Pa×s | 251.19 | Calculated Property |
| η | 0.0007348 | Pa×s | 276.21 | Calculated Property |
| η | 0.0006273 | Pa×s | 301.22 | Calculated Property |
| η | 0.0005486 | Pa×s | 326.24 | Calculated Property |
| η | 0.0004891 | Pa×s | 351.26 | Calculated Property |
| η | 0.0004427 | Pa×s | 376.27 | Calculated Property |
| η | 0.0004057 | Pa×s | 401.29 | Calculated Property |
| η | 0.0003757 | Pa×s | 426.30 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-methyl-trans-2-(2-methyl)pentyl-cyclopropane.
Sources
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