- InChI
- InChI=1S/C9H14/c1-3-8-5-2-6-9(4-1)7-8/h1,3,8-9H,2,4-7H2
- InChI Key
- CEVDPSDZXGCLEI-UHFFFAOYSA-N
- Formula
- C9H14
- SMILES
- C1=CC2CCCC(C1)C2
- Molecular Weight1
- 122.21
- CAS
- 6671-66-5
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- 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 |
|---|---|---|---|
| ΔcH°solid | -5445.10 ± 1.30 | kJ/mol | NIST |
| ΔfG° | 140.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -49.10 ± 1.40 | kJ/mol | NIST |
| ΔfH°solid | -97.30 ± 1.30 | kJ/mol | NIST |
| ΔfusH° | 10.26 | kJ/mol | Joback Calculated Property |
| ΔsubH° | [48.20; 48.20] | kJ/mol |
|
| ΔsubH° | 48.20 ± 0.40 | kJ/mol | NIST |
| ΔsubH° | 48.20 | kJ/mol | NIST |
| ΔsubH° | 48.20 ± 0.40 | kJ/mol | NIST |
| ΔvapH° | 36.26 | kJ/mol | Joback Calculated Property |
| log10WS | -2.75 | Crippen Calculated Property | |
| logPoct/wat | 2.753 | Crippen Calculated Property | |
| McVol | 111.650 | ml/mol | McGowan Calculated Property |
| Pc | 3415.86 | kPa | Joback Calculated Property |
| Tboil | 430.77 | K | Joback Calculated Property |
| Tc | 649.36 | K | Joback Calculated Property |
| Tfus | 217.27 | K | Joback Calculated Property |
| Vc | 0.415 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [226.80; 324.39] | J/mol×K | [430.77; 649.36] |
|
| Cp,gas | 226.80 | J/mol×K | 430.77 | Joback Calculated Property |
| Cp,gas | 245.93 | J/mol×K | 467.20 | Joback Calculated Property |
| Cp,gas | 263.83 | J/mol×K | 503.63 | Joback Calculated Property |
| Cp,gas | 280.56 | J/mol×K | 540.06 | Joback Calculated Property |
| Cp,gas | 296.19 | J/mol×K | 576.50 | Joback Calculated Property |
| Cp,gas | 310.78 | J/mol×K | 612.93 | Joback Calculated Property |
| Cp,gas | 324.39 | J/mol×K | 649.36 | Joback Calculated Property |
| η | [0.0004387; 0.0020254] | Pa×s | [217.27; 430.77] |
|
| η | 0.0020254 | Pa×s | 217.27 | Joback Calculated Property |
| η | 0.0013118 | Pa×s | 252.85 | Joback Calculated Property |
| η | 0.0009458 | Pa×s | 288.44 | Joback Calculated Property |
| η | 0.0007327 | Pa×s | 324.02 | Joback Calculated Property |
| η | 0.0005970 | Pa×s | 359.60 | Joback Calculated Property |
| η | 0.0005047 | Pa×s | 395.19 | Joback Calculated Property |
| η | 0.0004387 | Pa×s | 430.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Bicyclo(3.3.1)non-2-ene.
Sources
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