- InChI
- InChI=1S/C7H12/c1-2-4-6-7-5-3-1/h1-2H,3-7H2
- InChI Key
- ZXIJMRYMVAMXQP-UHFFFAOYSA-N
- Formula
- C7H12
- SMILES
- C1=CCCCCC1
- Molecular Weight1
- 96.17
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase 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).
- S°liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
- 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 | 0.1833 | Relay (1.0) Calculated Property | |
| ΔfG° | 58.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -20.69 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 3.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.05 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.93 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.07 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.507 | Crippen Calculated Property | |
| McVol | 94.330 | ml/mol | McGowan Calculated Property |
| Pc | 3950.57 | kPa | Joback Calculated Property |
| S°liquid | 241.00 | J/mol×K | NIST |
| Tboil | 386.89 | K | Relay (1.0) Calculated Property |
| Tc | 585.05 | K | Relay (1.0) Calculated Property |
| Tfus | 208.13 | K | Relay (1.0) Calculated Property |
| Vc | 0.333 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,liquid | 171.70 | J/mol×K | 298.15 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [102.23; 329.36] | 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 | -7.23600e+01 | |||
| Coefficient B | 7.51800e-01 | |||
| Coefficient C | -4.34280e-04 | |||
| Coefficient D | 8.42000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 102.23 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 142.98 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 179.24 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 211.26 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 239.31 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 263.66 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 284.57 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 302.32 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 317.16 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 329.36 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0221512; 0.0001904] | Pa×s | [177.51; 421.32] |
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 | -1.20299e+01 | |||
| Coefficient B | 1.45913e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 177.51 | |||
| Temperature range, max. | 421.32 | |||
| η | 0.0221512 | Pa×s | 177.51 | Calculated Property |
| η | 0.0074599 | Pa×s | 204.60 | Calculated Property |
| η | 0.0032404 | Pa×s | 231.69 | Calculated Property |
| η | 0.0016760 | Pa×s | 258.78 | Calculated Property |
| η | 0.0009823 | Pa×s | 285.87 | Calculated Property |
| η | 0.0006315 | Pa×s | 312.96 | Calculated Property |
| η | 0.0004356 | Pa×s | 340.05 | Calculated Property |
| η | 0.0003174 | Pa×s | 367.14 | Calculated Property |
| η | 0.0002415 | Pa×s | 394.23 | Calculated Property |
| η | 0.0001904 | Pa×s | 421.32 | Calculated Property |
Similar Compounds
Find more compounds similar to cis-Cycloheptene.
Sources
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