- InChI
- InChI=1S/C8H12O/c1-7(9)8-5-3-2-4-6-8/h5H,2-4,6H2,1H3
- InChI Key
- LTYLUDGDHUEBGX-UHFFFAOYSA-N
- Formula
- C8H12O
- SMILES
- CC(=O)C1=CCCCC1
- Molecular Weight1
- 124.18
- CAS
- 932-66-1
- Other Names
-
- Ketone, 1-cyclohexen-1-yl methyl
- Methyl 1-cyclohexenyl ketone
- 1-Acetylcyclohexene
- 1-Cyclohexen-1-yl methyl ketone
- 1-Acetyl-1-cyclohexene
- 1-[1-cyclohexen-1-yl]-ethanone
- cyclohex-1-enylmethylketone
- 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).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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° | -59.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -200.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.84 | kJ/mol | Joback Calculated Property |
| log10WS | -2.20 | Crippen Calculated Property | |
| logPoct/wat | 2.076 | Crippen Calculated Property | |
| McVol | 109.990 | ml/mol | McGowan Calculated Property |
| Pc | 3611.55 | kPa | Joback Calculated Property |
| Inp | [931.00; 1023.00] |
|
|
| Inp | 1023.00 | NIST | |
| Inp | 931.00 | NIST | |
| Inp | 1023.00 | NIST | |
| Tboil | [474.70; 475.00] | K |
|
| Tboil | 474.70 | K | NIST |
| Tboil | 475.00 ± 7.00 | K | NIST |
| Tc | 681.88 | K | Joback Calculated Property |
| Tfus | 346.00 | K | NIST |
| Vc | 0.409 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [223.02; 298.08] | J/mol×K | [464.67; 681.88] |
|
| Cp,gas | 223.02 | J/mol×K | 464.67 | Joback Calculated Property |
| Cp,gas | 237.48 | J/mol×K | 500.87 | Joback Calculated Property |
| Cp,gas | 251.13 | J/mol×K | 537.07 | Joback Calculated Property |
| Cp,gas | 263.98 | J/mol×K | 573.27 | Joback Calculated Property |
| Cp,gas | 276.08 | J/mol×K | 609.48 | Joback Calculated Property |
| Cp,gas | 287.44 | J/mol×K | 645.68 | Joback Calculated Property |
| Cp,gas | 298.08 | J/mol×K | 681.88 | Joback Calculated Property |
| η | [0.0002951; 0.0044881] | Pa×s | [254.75; 464.67] |
|
| η | 0.0044881 | Pa×s | 254.75 | Joback Calculated Property |
| η | 0.0021682 | Pa×s | 289.74 | Joback Calculated Property |
| η | 0.0012253 | Pa×s | 324.72 | Joback Calculated Property |
| η | 0.0007737 | Pa×s | 359.71 | Joback Calculated Property |
| η | 0.0005300 | Pa×s | 394.70 | Joback Calculated Property |
| η | 0.0003862 | Pa×s | 429.68 | Joback Calculated Property |
| η | 0.0002951 | Pa×s | 464.67 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 474.50 ± 0.50 | K | 2.70 | NIST |
Similar Compounds
Find more compounds similar to Ethanone, 1-(1-cyclohexen-1-yl)-.
Sources
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