- InChI
- InChI=1S/C6H12O/c1-5(2)6(3,4)7/h7H,1H2,2-4H3
- InChI Key
- AWDLBZUXUNIODN-UHFFFAOYSA-N
- Formula
- C6H12O
- SMILES
- C=C(C)C(C)(C)O
- Molecular Weight1
- 100.16
- CAS
- 10473-13-9
- Other Names
-
- CH2=C(CH3)C(CH3)2OH
- 2,3-Dimethyl-3-buten-2-ol
- 2,3-Dimethyl-1-buten-3-ol
- 3-Hydroxy-2,3-dimethyl-1-butene
- 2,3-Dimethylbut-3-en-2-ol
- 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).
- 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).
- Inp : Non-polar retention indices.
- 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° | -55.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -212.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 5.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.74 | kJ/mol | Joback Calculated Property |
| log10WS | -1.56 | Crippen Calculated Property | |
| logPoct/wat | 1.333 | Crippen Calculated Property | |
| McVol | 96.970 | ml/mol | McGowan Calculated Property |
| Pc | 3736.23 | kPa | Joback Calculated Property |
| Inp | 746.00 | NIST | |
| Tboil | 422.19 | K | Joback Calculated Property |
| Tc | 600.01 | K | Joback Calculated Property |
| Tfus | 204.90 | K | Joback Calculated Property |
| Vc | 0.361 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [194.48; 247.71] | J/mol×K | [422.19; 600.01] | 
|
| Cp,gas | 194.48 | J/mol×K | 422.19 | Joback Calculated Property |
| Cp,gas | 204.64 | J/mol×K | 451.83 | Joback Calculated Property |
| Cp,gas | 214.24 | J/mol×K | 481.46 | Joback Calculated Property |
| Cp,gas | 223.33 | J/mol×K | 511.10 | Joback Calculated Property |
| Cp,gas | 231.92 | J/mol×K | 540.73 | Joback Calculated Property |
| Cp,gas | 240.04 | J/mol×K | 570.37 | Joback Calculated Property |
| Cp,gas | 247.71 | J/mol×K | 600.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Buten-2-ol, 2,3-dimethyl-.
Sources
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