- InChI
- InChI=1S/C9H14O2/c1-2-3-4-7-5-6-8(10)9(7)11/h11H,2-6H2,1H3
- InChI Key
- UJTQSQADRGAFHN-UHFFFAOYSA-N
- Formula
- C9H14O2
- SMILES
- CCCCC1=C(O)C(=O)CC1
- Molecular Weight1
- 154.21
- CAS
- 29798-72-9
- Other Names
-
- 2-Cyclopenten-1-one, 3-butyl-2-hydroxy
- 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).
- 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° | -179.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -403.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.74 | kJ/mol | Joback Calculated Property |
| log10WS | -2.44 | Crippen Calculated Property | |
| logPoct/wat | 2.352 | Crippen Calculated Property | |
| McVol | 129.950 | ml/mol | McGowan Calculated Property |
| Pc | 3318.18 | kPa | Joback Calculated Property |
| Tboil | 594.39 | K | Joback Calculated Property |
| Tc | 793.69 | K | Joback Calculated Property |
| Tfus | 361.17 | K | Joback Calculated Property |
| Vc | 0.493 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [328.33; 393.94] | J/mol×K | [594.39; 793.69] | 
|
| Cp,gas | 328.33 | J/mol×K | 594.39 | Joback Calculated Property |
| Cp,gas | 340.69 | J/mol×K | 627.61 | Joback Calculated Property |
| Cp,gas | 352.48 | J/mol×K | 660.82 | Joback Calculated Property |
| Cp,gas | 363.69 | J/mol×K | 694.04 | Joback Calculated Property |
| Cp,gas | 374.34 | J/mol×K | 727.26 | Joback Calculated Property |
| Cp,gas | 384.42 | J/mol×K | 760.47 | Joback Calculated Property |
| Cp,gas | 393.94 | J/mol×K | 793.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Butyl-2-hydroxy-2-cyclopenten-1-one.
Sources
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