- 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
- Other Names
-
- 1-Hexen-3-ol, 3-methyl-
- 3-Methyl-hexen-(1)-ol-(3)
- ω : Acentric Factor.
- 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).
- 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 | 0.5537 | Relay (1.0) Calculated Property | |
| ΔfG° | -38.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -245.48 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 9.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.11 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.63 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.74 | Relay (1.0) 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 | 587.69 | K | Relay (1.0) Calculated Property |
| Tfus | 220.21 | K | Relay (1.0) Calculated Property |
| Vc | 0.403 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [234.17; 292.41] | J/mol×K | [445.39; 618.79] | 
|
| Cp,gas | 234.17 | J/mol×K | 445.39 | Joback Calculated Property |
| Cp,gas | 245.20 | J/mol×K | 474.29 | Joback Calculated Property |
| Cp,gas | 255.68 | J/mol×K | 503.19 | Joback Calculated Property |
| Cp,gas | 265.61 | J/mol×K | 532.09 | Joback Calculated Property |
| Cp,gas | 275.02 | J/mol×K | 560.99 | Joback Calculated Property |
| Cp,gas | 283.95 | J/mol×K | 589.89 | Joback Calculated Property |
| Cp,gas | 292.41 | J/mol×K | 618.79 | Joback Calculated Property |
| η | [0.0002249; 0.0922078] | Pa×s | [230.13; 445.39] |
|
| η | 0.0922078 | Pa×s | 230.13 | Joback Calculated Property |
| η | 0.0172057 | Pa×s | 266.01 | Joback Calculated Property |
| η | 0.0047849 | Pa×s | 301.88 | Joback Calculated Property |
| η | 0.0017464 | Pa×s | 337.76 | Joback Calculated Property |
| η | 0.0007735 | Pa×s | 373.64 | Joback Calculated Property |
| η | 0.0003952 | Pa×s | 409.51 | Joback Calculated Property |
| η | 0.0002249 | Pa×s | 445.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Methyl-1-hexen-3-ol.
Sources
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