- InChI
- InChI=1S/C16H16/c1-3-7-13(8-4-1)15-11-12-16(15)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2/t15-,16+
- InChI Key
- AERGGMDNGDDGPI-IYBDPMFKSA-N
- Formula
- C16H16
- SMILES
- c1ccc(C2CCC2c2ccccc2)cc1
- Molecular Weight1
- 208.30
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 349.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 145.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.54 | kJ/mol | Joback Calculated Property |
| log10WS | -4.55 | Crippen Calculated Property | |
| logPoct/wat | 4.348 | Crippen Calculated Property | |
| McVol | 177.920 | ml/mol | McGowan Calculated Property |
| Pc | 2576.72 | kPa | Joback Calculated Property |
| Inp | [1640.00; 1640.00] |
|
|
| Inp | 1640.00 | NIST | |
| Inp | 1640.00 | NIST | |
| Tboil | 625.18 | K | Joback Calculated Property |
| Tc | 881.09 | K | Joback Calculated Property |
| Tfus | 333.10 | K | Joback Calculated Property |
| Vc | 0.663 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [461.63; 563.88] | J/mol×K | [625.18; 881.09] |
|
| Cp,gas | 461.63 | J/mol×K | 625.18 | Joback Calculated Property |
| Cp,gas | 482.65 | J/mol×K | 667.83 | Joback Calculated Property |
| Cp,gas | 501.91 | J/mol×K | 710.48 | Joback Calculated Property |
| Cp,gas | 519.54 | J/mol×K | 753.14 | Joback Calculated Property |
| Cp,gas | 535.66 | J/mol×K | 795.79 | Joback Calculated Property |
| Cp,gas | 550.39 | J/mol×K | 838.44 | Joback Calculated Property |
| Cp,gas | 563.88 | J/mol×K | 881.09 | Joback Calculated Property |
| η | [0.0003289; 0.0021353] | Pa×s | [333.10; 625.18] |
|
| η | 0.0021353 | Pa×s | 333.10 | Joback Calculated Property |
| η | 0.0012816 | Pa×s | 381.78 | Joback Calculated Property |
| η | 0.0008633 | Pa×s | 430.46 | Joback Calculated Property |
| η | 0.0006302 | Pa×s | 479.14 | Joback Calculated Property |
| η | 0.0004875 | Pa×s | 527.82 | Joback Calculated Property |
| η | 0.0003938 | Pa×s | 576.50 | Joback Calculated Property |
| η | 0.0003289 | Pa×s | 625.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclobutane, 1,2-diphenyl, cis.
Sources
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