- InChI
- InChI=1S/C11H20O2/c1-4-7-8-9-10-11(12-5-2)13-6-3/h11H,4-8H2,1-3H3
- InChI Key
- NKXTVBJJMIROGV-UHFFFAOYSA-N
- Formula
- C11H20O2
- SMILES
- CCCCC#CC(OCC)OCC
- Molecular Weight1
- 184.28
- CAS
- 18232-30-9
- ω : Acentric Factor.
- 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).
- 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 | 0.4316 | Relay (1.0) Calculated Property | |
| ΔfG° | 32.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -248.53 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.10 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.33 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.52 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.579 | Crippen Calculated Property | |
| McVol | 168.990 | ml/mol | McGowan Calculated Property |
| Pc | 2183.60 | kPa | Joback Calculated Property |
| Tboil | 456.75 | K | Relay (1.0) Calculated Property |
| Tc | 625.14 | K | Relay (1.0) Calculated Property |
| Tfus | 200.65 | K | Relay (1.0) Calculated Property |
| Vc | 0.621 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [383.97; 467.47] | J/mol×K | [504.48; 689.45] | 
|
| Cp,gas | 383.97 | J/mol×K | 504.48 | Joback Calculated Property |
| Cp,gas | 399.23 | J/mol×K | 535.31 | Joback Calculated Property |
| Cp,gas | 413.96 | J/mol×K | 566.14 | Joback Calculated Property |
| Cp,gas | 428.15 | J/mol×K | 596.96 | Joback Calculated Property |
| Cp,gas | 441.80 | J/mol×K | 627.79 | Joback Calculated Property |
| Cp,gas | 454.91 | J/mol×K | 658.62 | Joback Calculated Property |
| Cp,gas | 467.47 | J/mol×K | 689.45 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to C11H20O2.
Sources
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