- InChI
- InChI=1S/C7H14O/c1-4-6-7(3,8)5-2/h5,8H,2,4,6H2,1,3H3
- InChI Key
- JNLMZYGDTPRAMM-UHFFFAOYSA-N
- Formula
- C7H14O
- SMILES
- C=CC(C)(O)CCC
- Molecular Weight1
- 114.19
- CAS
- 55145-28-3
- Other Names
-
- 1-Hexen-3-ol, 3-methyl-
- 3-Methyl-hexen-(1)-ol-(3)
- 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° | -38.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -223.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.89 | kJ/mol | Joback Calculated Property |
| log10WS | -1.98 | Crippen Calculated Property | |
| logPoct/wat | 1.723 | Crippen Calculated Property | |
| McVol | 111.060 | ml/mol | McGowan Calculated Property |
| Pc | 3314.37 | kPa | Joback Calculated Property |
| Tboil | 405.15 ± 3.00 | K | NIST |
| Tc | 618.51 | K | Joback Calculated Property |
| Tfus | 230.13 | K | Joback Calculated Property |
| Vc | 0.416 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [234.09; 292.33] | J/mol×K | [445.19; 618.51] | 
|
| Cp,gas | 234.09 | J/mol×K | 445.19 | Joback Calculated Property |
| Cp,gas | 245.12 | J/mol×K | 474.08 | Joback Calculated Property |
| Cp,gas | 255.60 | J/mol×K | 502.96 | Joback Calculated Property |
| Cp,gas | 265.53 | J/mol×K | 531.85 | Joback Calculated Property |
| Cp,gas | 274.94 | J/mol×K | 560.74 | Joback Calculated Property |
| Cp,gas | 283.87 | J/mol×K | 589.63 | Joback Calculated Property |
| Cp,gas | 292.33 | J/mol×K | 618.51 | Joback Calculated Property |
| η | [0.0002256; 0.0922078] | Pa×s | [230.13; 445.19] |
|
| η | 0.0922078 | Pa×s | 230.13 | Joback Calculated Property |
| η | 0.0172289 | Pa×s | 265.97 | Joback Calculated Property |
| η | 0.0047949 | Pa×s | 301.82 | Joback Calculated Property |
| η | 0.0017508 | Pa×s | 337.66 | Joback Calculated Property |
| η | 0.0007757 | Pa×s | 373.50 | Joback Calculated Property |
| η | 0.0003963 | Pa×s | 409.35 | Joback Calculated Property |
| η | 0.0002256 | Pa×s | 445.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Methyl-1-hexen-3-ol.
Sources
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