- InChI
- InChI=1S/C6H12O/c1-3-6(2)4-5-7/h3,6-7H,1,4-5H2,2H3
- InChI Key
- VTCQTYOGWYLVES-UHFFFAOYSA-N
- Formula
- C6H12O
- SMILES
- C=CC(C)CCO
- Molecular Weight1
- 100.16
- CAS
- 51174-44-8
- Other Names
-
- 3-Methyl-4-penten-1-ol
- 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).
- Pvap : Vapor 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° | -51.78 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -199.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 10.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.57 | kJ/mol | Joback Calculated Property |
| log10WS | -1.21 | Crippen Calculated Property | |
| logPoct/wat | 1.191 | Crippen Calculated Property | |
| McVol | 96.970 | ml/mol | McGowan Calculated Property |
| Pc | 3664.21 | kPa | Joback Calculated Property |
| Tboil | 425.10 | K | Joback Calculated Property |
| Tc | 592.88 | K | Joback Calculated Property |
| Tfus | 201.44 | K | Joback Calculated Property |
| Vc | 0.365 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [192.23; 241.94] | J/mol×K | [425.10; 592.88] | 
|
| Cp,gas | 192.23 | J/mol×K | 425.10 | Joback Calculated Property |
| Cp,gas | 201.41 | J/mol×K | 453.06 | Joback Calculated Property |
| Cp,gas | 210.23 | J/mol×K | 481.03 | Joback Calculated Property |
| Cp,gas | 218.68 | J/mol×K | 508.99 | Joback Calculated Property |
| Cp,gas | 226.77 | J/mol×K | 536.95 | Joback Calculated Property |
| Cp,gas | 234.52 | J/mol×K | 564.91 | Joback Calculated Property |
| Cp,gas | 241.94 | J/mol×K | 592.88 | Joback Calculated Property |
| η | [0.0002428; 0.1985438] | Pa×s | [201.44; 425.10] |
|
| η | 0.1985438 | Pa×s | 201.44 | Joback Calculated Property |
| η | 0.0271287 | Pa×s | 238.72 | Joback Calculated Property |
| η | 0.0063461 | Pa×s | 275.99 | Joback Calculated Property |
| η | 0.0020977 | Pa×s | 313.27 | Joback Calculated Property |
| η | 0.0008774 | Pa×s | 350.55 | Joback Calculated Property |
| η | 0.0004340 | Pa×s | 387.82 | Joback Calculated Property |
| η | 0.0002428 | Pa×s | 425.10 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [317.32; 452.13] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.50131e+01 | |||
| Coefficient B | -3.83367e+03 | |||
| Coefficient C | -5.69790e+01 | |||
| Temperature range, min. | 317.32 | |||
| Temperature range, max. | 452.13 | |||
| Pvap | 1.33 | kPa | 317.32 | Calculated Property |
| Pvap | 2.97 | kPa | 332.30 | Calculated Property |
| Pvap | 6.09 | kPa | 347.28 | Calculated Property |
| Pvap | 11.65 | kPa | 362.26 | Calculated Property |
| Pvap | 20.96 | kPa | 377.24 | Calculated Property |
| Pvap | 35.78 | kPa | 392.21 | Calculated Property |
| Pvap | 58.35 | kPa | 407.19 | Calculated Property |
| Pvap | 91.42 | kPa | 422.17 | Calculated Property |
| Pvap | 138.26 | kPa | 437.15 | Calculated Property |
| Pvap | 202.63 | kPa | 452.13 | Calculated Property |
Similar Compounds
Find more compounds similar to 4-Penten-1-ol, 3-methyl-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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