- InChI
- InChI=1S/C6H14O/c1-5(2)6(3)4-7/h5-7H,4H2,1-3H3
- InChI Key
- SXSWMAUXEHKFGX-UHFFFAOYSA-N
- Formula
- C6H14O
- SMILES
- CC(C)C(C)CO
- Molecular Weight1
- 102.17
- CAS
- 20281-85-0
- 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).
- 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° | -142.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -329.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.85 | kJ/mol | Joback Calculated Property |
| log10WS | -1.11 | Crippen Calculated Property | |
| logPoct/wat | 1.271 | Crippen Calculated Property | |
| McVol | 101.270 | ml/mol | McGowan Calculated Property |
| Pc | 3517.91 | kPa | Joback Calculated Property |
| Tboil | 417.70 | K | NIST |
| Tc | 596.11 | K | Joback Calculated Property |
| Tfus | 188.20 | K | Joback Calculated Property |
| Vc | 0.379 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [207.81; 262.76] | J/mol×K | [427.98; 596.11] | 
|
| Cp,gas | 207.81 | J/mol×K | 427.98 | Joback Calculated Property |
| Cp,gas | 217.90 | J/mol×K | 456.00 | Joback Calculated Property |
| Cp,gas | 227.60 | J/mol×K | 484.02 | Joback Calculated Property |
| Cp,gas | 236.93 | J/mol×K | 512.04 | Joback Calculated Property |
| Cp,gas | 245.89 | J/mol×K | 540.06 | Joback Calculated Property |
| Cp,gas | 254.50 | J/mol×K | 568.09 | Joback Calculated Property |
| Cp,gas | 262.76 | J/mol×K | 596.11 | Joback Calculated Property |
| η | [0.0002307; 0.6544822] | Pa×s | [188.20; 427.98] |
|
| η | 0.6544822 | Pa×s | 188.20 | Joback Calculated Property |
| η | 0.0545090 | Pa×s | 228.16 | Joback Calculated Property |
| η | 0.0095238 | Pa×s | 268.13 | Joback Calculated Property |
| η | 0.0026164 | Pa×s | 308.09 | Joback Calculated Property |
| η | 0.0009671 | Pa×s | 348.05 | Joback Calculated Property |
| η | 0.0004388 | Pa×s | 388.02 | Joback Calculated Property |
| η | 0.0002307 | Pa×s | 427.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Butanol, 2,3-dimethyl-.
Sources
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