- InChI
- InChI=1S/C7H10/c1-2-4-6-7-5-3-1/h1-4H,5-7H2
- InChI Key
- GWYPDXLJACEENP-UHFFFAOYSA-N
- Formula
- C7H10
- SMILES
- C1=CCCCC=C1
- Molecular Weight1
- 94.15
- CAS
- 4054-38-0
- Other Names
-
- Cyclohepta-1,3-diene
- 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.
- I : 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 |
|---|---|---|---|
| ΔfG° | 88.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -3.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 4.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 32.67 | kJ/mol | Joback Calculated Property |
| IE | [8.31; 8.40] | eV |
|
| IE | 8.40 | eV | NIST |
| IE | 8.31 ± 0.03 | eV | NIST |
| IE | 8.31 | eV | NIST |
| log10WS | -2.35 | Crippen Calculated Property | |
| logPoct/wat | 2.283 | Crippen Calculated Property | |
| McVol | 90.030 | ml/mol | McGowan Calculated Property |
| Pc | 4135.61 | kPa | Joback Calculated Property |
| Inp | [796.00; 831.00] |
|
|
| Inp | 820.30 | NIST | |
| Inp | 831.00 | NIST | |
| Inp | 815.00 | NIST | |
| Inp | 796.00 | NIST | |
| Inp | 804.00 | NIST | |
| Inp | 811.00 | NIST | |
| Inp | 811.00 | NIST | |
| Inp | 815.00 | NIST | |
| Inp | 804.00 | NIST | |
| Inp | 820.30 | NIST | |
| I | [1060.00; 1060.00] |
|
|
| I | 1060.00 | NIST | |
| I | 1060.00 | NIST | |
| I | 1060.00 | NIST | |
| Tboil | 393.70 | K | NIST |
| Tc | 603.08 | K | Joback Calculated Property |
| Tfus | 178.27 | K | Joback Calculated Property |
| Vc | 0.326 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [146.42; 221.11] | J/mol×K | [386.37; 603.08] |
|
| Cp,gas | 146.42 | J/mol×K | 386.37 | Joback Calculated Property |
| Cp,gas | 160.81 | J/mol×K | 422.49 | Joback Calculated Property |
| Cp,gas | 174.38 | J/mol×K | 458.61 | Joback Calculated Property |
| Cp,gas | 187.18 | J/mol×K | 494.73 | Joback Calculated Property |
| Cp,gas | 199.21 | J/mol×K | 530.85 | Joback Calculated Property |
| Cp,gas | 210.51 | J/mol×K | 566.96 | Joback Calculated Property |
| Cp,gas | 221.11 | J/mol×K | 603.08 | Joback Calculated Property |
| η | [0.0002411; 0.0148277] | Pa×s | [178.27; 386.37] |
|
| η | 0.0148277 | Pa×s | 178.27 | Joback Calculated Property |
| η | 0.0042670 | Pa×s | 212.95 | Joback Calculated Property |
| η | 0.0017406 | Pa×s | 247.64 | Joback Calculated Property |
| η | 0.0008850 | Pa×s | 282.32 | Joback Calculated Property |
| η | 0.0005218 | Pa×s | 317.00 | Joback Calculated Property |
| η | 0.0003414 | Pa×s | 351.69 | Joback Calculated Property |
| η | 0.0002411 | Pa×s | 386.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Cycloheptadiene.
Sources
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