- InChI
- InChI=1S/C12H16/c1-3-12(2)9-8-10-6-4-5-7-11(10)12/h4-7H,3,8-9H2,1-2H3
- InChI Key
- PVWWWDUASYPYLN-UHFFFAOYSA-N
- Formula
- C12H16
- SMILES
- CCC1(C)CCc2ccccc21
- Molecular Weight1
- 160.26
- CAS
- 56298-75-0
- 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).
- 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 | 0.3514 | Relay (1.0) Calculated Property | |
| ΔfG° | 208.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 5.19 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.49 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.37 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.29 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.300 | Crippen Calculated Property | |
| McVol | 145.320 | ml/mol | McGowan Calculated Property |
| Pc | 2832.35 | kPa | Joback Calculated Property |
| Tboil | 498.83 | K | Relay (1.0) Calculated Property |
| Tc | 726.19 | K | Relay (1.0) Calculated Property |
| Tfus | 239.32 | K | Relay (1.0) Calculated Property |
| Vc | 0.528 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [332.16; 420.75] | J/mol×K | [512.60; 738.14] | 
|
| Cp,gas | 332.16 | J/mol×K | 512.60 | Joback Calculated Property |
| Cp,gas | 349.70 | J/mol×K | 550.19 | Joback Calculated Property |
| Cp,gas | 365.90 | J/mol×K | 587.78 | Joback Calculated Property |
| Cp,gas | 380.94 | J/mol×K | 625.37 | Joback Calculated Property |
| Cp,gas | 394.98 | J/mol×K | 662.96 | Joback Calculated Property |
| Cp,gas | 408.20 | J/mol×K | 700.55 | Joback Calculated Property |
| Cp,gas | 420.75 | J/mol×K | 738.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1H-Indene, 1-ethyl-2,3-dihydro-1-methyl-.
Sources
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