- InChI
- InChI=1S/C9H14O/c1-7-3-4-9(6-10)5-8(7)2/h6,9H,3-5H2,1-2H3
- InChI Key
- NOJNKSAQZMVMFF-UHFFFAOYSA-N
- Formula
- C9H14O
- SMILES
- CC1=C(C)CC(C=O)CC1
- Molecular Weight1
- 138.21
- CAS
- 93861-86-0
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.3147 | Relay (... Calculated Property | |
| ΔfG° | -39.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -147.66 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 13.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.48 | kJ/mol | Relay (... Calculated Property |
| IE | 8.59 | eV | Relay (... Calculated Property |
| log10WS | -1.50 | Relay (... Calculated Property | |
| logPoct/wat | 2.322 | Crippen Calculated Property | |
| McVol | 124.080 | ml/mol | McGowan Calculated Property |
| Pc | 3096.73 | kPa | Joback Calculated Property |
| Tboil | 472.88 | K | Relay (... Calculated Property |
| Tc | 678.56 | K | Relay (... Calculated Property |
| Tfus | 240.37 | K | Relay (... Calculated Property |
| Vc | 0.424 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [268.51; 347.94] | J/mol×K | [482.65; 692.10] | 
|
| Cp,gas | 268.51 | J/mol×K | 482.65 | Joback Calculated Property |
| Cp,gas | 283.55 | J/mol×K | 517.56 | Joback Calculated Property |
| Cp,gas | 297.84 | J/mol×K | 552.47 | Joback Calculated Property |
| Cp,gas | 311.42 | J/mol×K | 587.38 | Joback Calculated Property |
| Cp,gas | 324.28 | J/mol×K | 622.29 | Joback Calculated Property |
| Cp,gas | 336.45 | J/mol×K | 657.19 | Joback Calculated Property |
| Cp,gas | 347.94 | J/mol×K | 692.10 | Joback Calculated Property |
| η | [0.0003040; 0.0026032] | Pa×s | [266.37; 482.65] |
|
| η | 0.0026032 | Pa×s | 266.37 | Joback Calculated Property |
| η | 0.0014704 | Pa×s | 302.42 | Joback Calculated Property |
| η | 0.0009380 | Pa×s | 338.46 | Joback Calculated Property |
| η | 0.0006525 | Pa×s | 374.51 | Joback Calculated Property |
| η | 0.0004837 | Pa×s | 410.56 | Joback Calculated Property |
| η | 0.0003764 | Pa×s | 446.60 | Joback Calculated Property |
| η | 0.0003040 | Pa×s | 482.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to C9H14O.
Sources
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