- InChI
- InChI=1S/C11H16/c1-9-5-7-11(3,4)8-6-10(9)2/h5-8H,1-4H3
- InChI Key
- YLIMFFFDYRTNMY-UHFFFAOYSA-N
- Formula
- C11H16
- SMILES
- CC1=C(C)C=CC(C)(C)C=C1
- Molecular Weight1
- 148.24
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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.
- 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 | 0.2334 | Relay (... Calculated Property | |
| ΔfG° | 119.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 49.05 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 10.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.71 | kJ/mol | Relay (... Calculated Property |
| IE | 7.72 | eV | Relay (... Calculated Property |
| log10WS | -4.23 | Relay (... Calculated Property | |
| logPoct/wat | 3.475 | Crippen Calculated Property | |
| McVol | 142.090 | ml/mol | McGowan Calculated Property |
| Pc | 2709.85 | kPa | Joback Calculated Property |
| Inp | 1034.50 | NIST | |
| Tboil | 437.35 | K | Relay (... Calculated Property |
| Tc | 635.91 | K | Relay (... Calculated Property |
| Tfus | 289.10 | K | Relay (... Calculated Property |
| Vc | 0.503 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [301.62; 389.85] | J/mol×K | [482.58; 702.60] | 
|
| Cp,gas | 301.62 | J/mol×K | 482.58 | Joback Calculated Property |
| Cp,gas | 318.72 | J/mol×K | 519.25 | Joback Calculated Property |
| Cp,gas | 334.71 | J/mol×K | 555.92 | Joback Calculated Property |
| Cp,gas | 349.72 | J/mol×K | 592.59 | Joback Calculated Property |
| Cp,gas | 363.84 | J/mol×K | 629.26 | Joback Calculated Property |
| Cp,gas | 377.18 | J/mol×K | 665.93 | Joback Calculated Property |
| Cp,gas | 389.85 | J/mol×K | 702.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,4,7,7-tetramethylcyclohepta-1,3,5-triene.
Sources
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