- InChI
- InChI=1S/C8H12O/c9-7-6-8-4-2-1-3-5-8/h1-2,7-8H,3-6H2
- InChI Key
- UPVGDGITFOERJA-UHFFFAOYSA-N
- Formula
- C8H12O
- SMILES
- O=CCC1CC=CCC1
- Molecular Weight1
- 124.18
- CAS
- 24480-99-7
- 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).
- 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° | -28.63 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -181.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.84 | kJ/mol | Joback Calculated Property |
| log10WS | -1.96 | Crippen Calculated Property | |
| logPoct/wat | 1.932 | Crippen Calculated Property | |
| McVol | 109.990 | ml/mol | McGowan Calculated Property |
| Pc | 3581.35 | kPa | Joback Calculated Property |
| Tboil | 449.81 | K | Joback Calculated Property |
| Tc | 659.50 | K | Joback Calculated Property |
| Tfus | 230.06 | K | Joback Calculated Property |
| Vc | 0.419 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [224.09; 301.56] | J/mol×K | [449.81; 659.50] | 
|
| Cp,gas | 224.09 | J/mol×K | 449.81 | Joback Calculated Property |
| Cp,gas | 238.96 | J/mol×K | 484.76 | Joback Calculated Property |
| Cp,gas | 253.01 | J/mol×K | 519.71 | Joback Calculated Property |
| Cp,gas | 266.27 | J/mol×K | 554.66 | Joback Calculated Property |
| Cp,gas | 278.77 | J/mol×K | 589.61 | Joback Calculated Property |
| Cp,gas | 290.52 | J/mol×K | 624.55 | Joback Calculated Property |
| Cp,gas | 301.56 | J/mol×K | 659.50 | Joback Calculated Property |
| η | [0.0003413; 0.0052247] | Pa×s | [230.06; 449.81] |
|
| η | 0.0052247 | Pa×s | 230.06 | Joback Calculated Property |
| η | 0.0024264 | Pa×s | 266.69 | Joback Calculated Property |
| η | 0.0013561 | Pa×s | 303.31 | Joback Calculated Property |
| η | 0.0008592 | Pa×s | 339.93 | Joback Calculated Property |
| η | 0.0005949 | Pa×s | 376.56 | Joback Calculated Property |
| η | 0.0004396 | Pa×s | 413.18 | Joback Calculated Property |
| η | 0.0003413 | Pa×s | 449.81 | Joback Calculated Property |
Similar Compounds
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Sources
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