- InChI
- InChI=1S/C13H18/c1-9-5-6-12-11(10(9)2)7-8-13(12,3)4/h5-6H,7-8H2,1-4H3
- InChI Key
- BKSQAMSHSDSRGZ-UHFFFAOYSA-N
- Formula
- C13H18
- SMILES
- Cc1ccc2c(c1C)CCC2(C)C
- Molecular Weight1
- 174.28
- CAS
- 16204-57-2
- Other Names
-
- Indan, 1,1,4,5-tetramethyl-
- 1,1,4,5-Tetramethylindan
- 1,1,4,5-Tetramethylindane
- Indene, 2,3-dihydro, 1,1,4,5-tetramethyl
- 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).
- 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° | 197.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -21.49 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.56 | kJ/mol | Joback Calculated Property |
| log10WS | -4.02 | Crippen Calculated Property | |
| logPoct/wat | 3.527 | Crippen Calculated Property | |
| McVol | 159.410 | ml/mol | McGowan Calculated Property |
| Pc | 2487.55 | kPa | Joback Calculated Property |
| Inp | 1355.00 | NIST | |
| Tboil | 545.44 | K | Joback Calculated Property |
| Tc | 769.28 | K | Joback Calculated Property |
| Tfus | 342.09 | K | Joback Calculated Property |
| Vc | 0.611 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [379.74; 469.93] | J/mol×K | [545.44; 769.28] | 
|
| Cp,gas | 379.74 | J/mol×K | 545.44 | Joback Calculated Property |
| Cp,gas | 397.09 | J/mol×K | 582.75 | Joback Calculated Property |
| Cp,gas | 413.31 | J/mol×K | 620.05 | Joback Calculated Property |
| Cp,gas | 428.55 | J/mol×K | 657.36 | Joback Calculated Property |
| Cp,gas | 442.97 | J/mol×K | 694.67 | Joback Calculated Property |
| Cp,gas | 456.71 | J/mol×K | 731.97 | Joback Calculated Property |
| Cp,gas | 469.93 | J/mol×K | 769.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1H-Indene, 2,3-dihydro-1,1,4,5-tetramethyl-.
Sources
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