- InChI
- InChI=1S/C10H14O/c1-3-4-5-9-8(2)6-7-10(9)11/h3-4H,5-7H2,1-2H3/b4-3-
- InChI Key
- IVLCENBZDYVJPA-ARJAWSKDSA-N
- Formula
- C10H14O
- SMILES
- CC=CCC1=C(C)CCC1=O
- Molecular Weight1
- 150.22
- CAS
- 17190-71-5
- Other Names
-
- (Z)-Cinerone
- Cineron
- Cinerone
- 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° | 45.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -154.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.24 | kJ/mol | Joback Calculated Property |
| log10WS | -2.89 | Crippen Calculated Property | |
| logPoct/wat | 2.632 | Crippen Calculated Property | |
| McVol | 133.870 | ml/mol | McGowan Calculated Property |
| Pc | 2853.57 | kPa | Joback Calculated Property |
| Inp | [1183.80; 1183.80] |
|
|
| Inp | 1183.80 | NIST | |
| Inp | 1183.80 | NIST | |
| Tboil | 529.25 | K | Joback Calculated Property |
| Tc | 749.45 | K | Joback Calculated Property |
| Tfus | 306.54 | K | Joback Calculated Property |
| Vc | 0.510 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [302.05; 381.77] | J/mol×K | [529.25; 749.45] |
|
| Cp,gas | 302.05 | J/mol×K | 529.25 | Joback Calculated Property |
| Cp,gas | 317.21 | J/mol×K | 565.95 | Joback Calculated Property |
| Cp,gas | 331.59 | J/mol×K | 602.65 | Joback Calculated Property |
| Cp,gas | 345.21 | J/mol×K | 639.35 | Joback Calculated Property |
| Cp,gas | 358.11 | J/mol×K | 676.05 | Joback Calculated Property |
| Cp,gas | 370.28 | J/mol×K | 712.75 | Joback Calculated Property |
| Cp,gas | 381.77 | J/mol×K | 749.45 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Cyclopenten-1-one, 2-(2-butenyl)-3-methyl-, (Z)-.
Sources
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