- InChI
- InChI=1S/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3/t5-/m0/s1
- InChI Key
- MXLMTQWGSQIYOW-YFKPBYRVSA-N
- Formula
- C5H12O
- SMILES
- CC(C)C(C)O
- Molecular Weight1
- 88.15
- CAS
- 1572-93-6
- 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° | -150.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -309.32 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 5.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.63 | kJ/mol | Joback Calculated Property |
| log10WS | -1.05 | Crippen Calculated Property | |
| logPoct/wat | 1.023 | Crippen Calculated Property | |
| McVol | 87.180 | ml/mol | McGowan Calculated Property |
| Pc | 3955.54 | kPa | Joback Calculated Property |
| Tboil | 405.10 | K | Joback Calculated Property |
| Tc | 574.03 | K | Joback Calculated Property |
| Tfus | 176.93 | K | Joback Calculated Property |
| Vc | 0.323 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [169.84; 218.33] | J/mol×K | [405.10; 574.03] | 
|
| Cp,gas | 169.84 | J/mol×K | 405.10 | Joback Calculated Property |
| Cp,gas | 178.73 | J/mol×K | 433.25 | Joback Calculated Property |
| Cp,gas | 187.29 | J/mol×K | 461.41 | Joback Calculated Property |
| Cp,gas | 195.52 | J/mol×K | 489.56 | Joback Calculated Property |
| Cp,gas | 203.43 | J/mol×K | 517.72 | Joback Calculated Property |
| Cp,gas | 211.03 | J/mol×K | 545.87 | Joback Calculated Property |
| Cp,gas | 218.33 | J/mol×K | 574.03 | Joback Calculated Property |
| η | [0.0002739; 0.9991270] | Pa×s | [176.93; 405.10] |
|
| η | 0.9991270 | Pa×s | 176.93 | Joback Calculated Property |
| η | 0.0759974 | Pa×s | 214.96 | Joback Calculated Property |
| η | 0.0125411 | Pa×s | 252.99 | Joback Calculated Property |
| η | 0.0033141 | Pa×s | 291.01 | Joback Calculated Property |
| η | 0.0011912 | Pa×s | 329.04 | Joback Calculated Property |
| η | 0.0005293 | Pa×s | 367.07 | Joback Calculated Property |
| η | 0.0002739 | Pa×s | 405.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (R)-(-)-3-Methyl-2-butanol.
Sources
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