- InChI
- InChI=1S/C5H10O/c1-2-3-4-5-6/h2,6H,1,3-5H2
- InChI Key
- LQAVWYMTUMSFBE-UHFFFAOYSA-N
- Formula
- C5H10O
- SMILES
- C=CCCCO
- Molecular Weight1
- 86.13
- CAS
- 821-09-0
- Other Names
-
- 4-Pentene-1-ol
- 4-Pentenol
- 4-Pentenyl alcohol
- CH2=CHCH2CH2CH2OH
- Pent-4-en-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).
- 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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : 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° | -57.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -173.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.73 | kJ/mol | Joback Calculated Property |
| IE | 9.42 ± 0.05 | eV | NIST |
| log10WS | [-0.15; -0.15] |
|
|
| log10WS | -0.15 | Aq. Sol... | |
| log10WS | -0.15 | Estimat... | |
| logPoct/wat | 0.945 | Crippen Calculated Property | |
| McVol | 82.880 | ml/mol | McGowan Calculated Property |
| Pc | 4088.15 | kPa | Joback Calculated Property |
| Inp | [717.00; 764.00] |
|
|
| Inp | 739.00 | NIST | |
| Inp | 730.00 | NIST | |
| Inp | 764.00 | NIST | |
| Inp | 757.00 | NIST | |
| Inp | 739.00 | NIST | |
| Inp | 730.00 | NIST | |
| Inp | 764.00 | NIST | |
| Inp | 757.00 | NIST | |
| Inp | 717.00 | NIST | |
| Inp | 745.00 | NIST | |
| I | [1276.00; 1308.00] |
|
|
| I | 1305.00 | NIST | |
| I | 1305.00 | NIST | |
| I | 1308.00 | NIST | |
| I | 1305.00 | NIST | |
| I | 1305.00 | NIST | |
| I | 1308.00 | NIST | |
| I | 1295.00 | NIST | |
| I | 1297.00 | NIST | |
| I | Outlier 1276.00 | NIST | |
| I | 1294.00 | NIST | |
| I | 1299.00 | NIST | |
| I | 1300.00 | NIST | |
| I | 1282.00 | NIST | |
| I | 1289.00 | NIST | |
| Tboil | [408.00; 414.20] | K |
|
| Tboil | 408.70 | K | NIST |
| Tboil | 414.20 | K | NIST |
| Tboil | 408.00 ± 3.00 | K | NIST |
| Tboil | 413.00 ± 5.00 | K | NIST |
| Tc | 567.49 | K | Joback Calculated Property |
| Tfus | 205.17 | K | Joback Calculated Property |
| Vc | 0.316 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [155.12; 197.00] | J/mol×K | [402.66; 567.49] |
|
| Cp,gas | 155.12 | J/mol×K | 402.66 | Joback Calculated Property |
| Cp,gas | 162.84 | J/mol×K | 430.13 | Joback Calculated Property |
| Cp,gas | 170.25 | J/mol×K | 457.60 | Joback Calculated Property |
| Cp,gas | 177.36 | J/mol×K | 485.07 | Joback Calculated Property |
| Cp,gas | 184.19 | J/mol×K | 512.54 | Joback Calculated Property |
| Cp,gas | 190.73 | J/mol×K | 540.02 | Joback Calculated Property |
| Cp,gas | 197.00 | J/mol×K | 567.49 | Joback Calculated Property |
| η | [0.0002939; 0.0992986] | Pa×s | [205.17; 402.66] |
|
| η | 0.0992986 | Pa×s | 205.17 | Joback Calculated Property |
| η | 0.0192385 | Pa×s | 238.09 | Joback Calculated Property |
| η | 0.0055532 | Pa×s | 271.00 | Joback Calculated Property |
| η | 0.0020980 | Pa×s | 303.91 | Joback Calculated Property |
| η | 0.0009587 | Pa×s | 336.83 | Joback Calculated Property |
| η | 0.0005036 | Pa×s | 369.75 | Joback Calculated Property |
| η | 0.0002939 | Pa×s | 402.66 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [0.28; 202.65] | kPa | [287.34; 431.87] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.59002e+01 | |||
| Coefficient B | -3.99316e+03 | |||
| Coefficient C | -5.47550e+01 | |||
| Temperature range, min. | 287.34 | |||
| Temperature range, max. | 431.87 | |||
| Pvap | 0.28 | kPa | 287.34 | Calculated Property |
| Pvap | 0.85 | kPa | 303.40 | Calculated Property |
| Pvap | 2.26 | kPa | 319.46 | Calculated Property |
| Pvap | 5.35 | kPa | 335.52 | Calculated Property |
| Pvap | 11.55 | kPa | 351.58 | Calculated Property |
| Pvap | 23.05 | kPa | 367.63 | Calculated Property |
| Pvap | 42.98 | kPa | 383.69 | Calculated Property |
| Pvap | 75.62 | kPa | 399.75 | Calculated Property |
| Pvap | 126.54 | kPa | 415.81 | Calculated Property |
| Pvap | 202.65 | kPa | 431.87 | Calculated Property |
Similar Compounds
Find more compounds similar to 4-Penten-1-ol.
Sources
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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that the value is more than 2 standard deviations away from the
property mean.