- InChI
- InChI=1S/C11H18O/c1-5-7-9-11(3,4)12-10-8-6-2/h5H,1,6,8,10H2,2-4H3
- InChI Key
- OUIQSMDXNSJEQD-UHFFFAOYSA-N
- Formula
- C11H18O
- SMILES
- C=CC#CC(C)(C)OCCCC
- Molecular Weight1
- 166.26
- CAS
- 819-41-0
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°liquid : Liquid phase 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 |
|---|---|---|---|
| ΔcH°liquid | -6836.00 ± 1.30 | kJ/mol | NIST |
| ΔfG° | 230.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -6.70 ± 1.40 | kJ/mol | NIST |
| ΔfH°liquid | -62.40 ± 1.40 | kJ/mol | NIST |
| ΔfusH° | 19.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [55.70; 55.70] | kJ/mol |
|
| ΔvapH° | 55.70 ± 0.10 | kJ/mol | NIST |
| ΔvapH° | 55.70 | kJ/mol | NIST |
| log10WS | -3.27 | Crippen Calculated Property | |
| logPoct/wat | 2.771 | Crippen Calculated Property | |
| McVol | 158.820 | ml/mol | McGowan Calculated Property |
| Pc | 2333.78 | kPa | Joback Calculated Property |
| Tboil | 475.95 | K | Joback Calculated Property |
| Tc | 673.47 | K | Joback Calculated Property |
| Tfus | 342.72 | K | Joback Calculated Property |
| Vc | 0.602 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [342.77; 426.55] | J/mol×K | [475.95; 673.47] |
|
| Cp,gas | 342.77 | J/mol×K | 475.95 | Joback Calculated Property |
| Cp,gas | 358.61 | J/mol×K | 508.87 | Joback Calculated Property |
| Cp,gas | 373.66 | J/mol×K | 541.79 | Joback Calculated Property |
| Cp,gas | 387.95 | J/mol×K | 574.71 | Joback Calculated Property |
| Cp,gas | 401.51 | J/mol×K | 607.63 | Joback Calculated Property |
| Cp,gas | 414.37 | J/mol×K | 640.55 | Joback Calculated Property |
| Cp,gas | 426.55 | J/mol×K | 673.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylvinylethynylmethanol butyl ether.
Sources
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