- InChI
- InChI=1S/C8H10/c1-8-6-4-2-3-5-7-8/h2-4,6-7H,5H2,1H3
- InChI Key
- UQJRWEWFCRBHQV-UHFFFAOYSA-N
- Formula
- C8H10
- SMILES
- CC1=CCC=CC=C1
- Molecular Weight1
- 106.17
- ω : Acentric Factor.
- 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.
- 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 | 0.1821 | Relay (1.0) Calculated Property | |
| ΔfG° | 116.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 149.97 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 8.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.01 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.99 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.449 | Crippen Calculated Property | |
| McVol | 99.820 | ml/mol | McGowan Calculated Property |
| Pc | 3763.78 | kPa | Joback Calculated Property |
| Inp | [890.00; 890.00] |
|
|
| Inp | 890.00 | NIST | |
| Inp | 890.00 | NIST | |
| Tboil | 405.58 | K | Relay (1.0) Calculated Property |
| Tc | 606.31 | K | Relay (1.0) Calculated Property |
| Tfus | 207.26 | K | Relay (1.0) Calculated Property |
| Vc | 0.345 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [173.68; 245.18] | J/mol×K | [413.39; 631.79] |
|
| Cp,gas | 173.68 | J/mol×K | 413.39 | Joback Calculated Property |
| Cp,gas | 187.43 | J/mol×K | 449.79 | Joback Calculated Property |
| Cp,gas | 200.42 | J/mol×K | 486.19 | Joback Calculated Property |
| Cp,gas | 212.66 | J/mol×K | 522.59 | Joback Calculated Property |
| Cp,gas | 224.19 | J/mol×K | 558.99 | Joback Calculated Property |
| Cp,gas | 235.02 | J/mol×K | 595.39 | Joback Calculated Property |
| Cp,gas | 245.18 | J/mol×K | 631.79 | Joback Calculated Property |
| η | [0.0002072; 0.0055690] | Pa×s | [202.82; 413.39] |
|
| η | 0.0055690 | Pa×s | 202.82 | Joback Calculated Property |
| η | 0.0021470 | Pa×s | 237.91 | Joback Calculated Property |
| η | 0.0010576 | Pa×s | 273.01 | Joback Calculated Property |
| η | 0.0006122 | Pa×s | 308.11 | Joback Calculated Property |
| η | 0.0003962 | Pa×s | 343.20 | Joback Calculated Property |
| η | 0.0002780 | Pa×s | 378.29 | Joback Calculated Property |
| η | 0.0002072 | Pa×s | 413.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3,5-Cycloheptatriene, methyl.
Sources
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