- InChI
- InChI=1S/C8H15NO/c1-8(2,10)6-5-7-9(3)4/h10H,7H2,1-4H3
- InChI Key
- VBARYRPUABJYGW-UHFFFAOYSA-N
- Formula
- C8H15NO
- SMILES
- CN(C)CC#CC(C)(C)O
- Molecular Weight1
- 141.21
- CAS
- 25400-83-3
- 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 | 0.5387 | Relay (1.0) Calculated Property | |
| ΔfG° | 196.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 10.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.11 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.35 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.322 | Crippen Calculated Property | |
| McVol | 130.830 | ml/mol | McGowan Calculated Property |
| Pc | 3392.03 | kPa | Joback Calculated Property |
| Tboil | 447.06 | K | Relay (1.0) Calculated Property |
| Tc | 629.24 | K | Relay (1.0) Calculated Property |
| Tfus | 285.83 | K | Relay (1.0) Calculated Property |
| Vc | 0.488 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [293.55; 358.20] | J/mol×K | [492.83; 681.20] | 
|
| Cp,gas | 293.55 | J/mol×K | 492.83 | Joback Calculated Property |
| Cp,gas | 305.92 | J/mol×K | 524.22 | Joback Calculated Property |
| Cp,gas | 317.61 | J/mol×K | 555.62 | Joback Calculated Property |
| Cp,gas | 328.65 | J/mol×K | 587.01 | Joback Calculated Property |
| Cp,gas | 339.07 | J/mol×K | 618.41 | Joback Calculated Property |
| Cp,gas | 348.91 | J/mol×K | 649.80 | Joback Calculated Property |
| Cp,gas | 358.20 | J/mol×K | 681.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-Dimethylamino-2-methyl-3-pentyn-2-ol.
Sources
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