- InChI
- InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h3H,1,4-7H2,2H3
- InChI Key
- MPLWNENKBSBMFN-UHFFFAOYSA-N
- Formula
- C8H14O2
- SMILES
- C=CCCCCOC(C)=O
- Molecular Weight1
- 142.20
- CAS
- 5048-26-0
- Other Names
-
- 5-Hexen-1-ol, 1-acetate
- 5-Hexen-1-ol, acetate
- 5-hexenyl acetate
- Acetic acid 5-hexenyl ester
- 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).
- 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 |
|---|---|---|---|
| ω | 0.4708 | Relay (1.0) Calculated Property | |
| ΔfG° | -206.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -418.60 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.46 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.44 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.92 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.906 | Crippen Calculated Property | |
| McVol | 126.720 | ml/mol | McGowan Calculated Property |
| Pc | 2659.77 | kPa | Joback Calculated Property |
| Inp | 1001.40 | NIST | |
| I | [1313.00; 1313.00] |
|
|
| I | 1313.00 | NIST | |
| I | 1313.00 | NIST | |
| I | 1313.00 | NIST | |
| I | 1313.00 | NIST | |
| Tboil | 443.09 | K | Relay (1.0) Calculated Property |
| Tc | 627.65 | K | Relay (1.0) Calculated Property |
| Tfus | 212.57 | K | Relay (1.0) Calculated Property |
| Vc | 0.469 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [258.19; 322.87] | J/mol×K | [437.54; 612.73] |
|
| Cp,gas | 258.19 | J/mol×K | 437.54 | Joback Calculated Property |
| Cp,gas | 270.13 | J/mol×K | 466.74 | Joback Calculated Property |
| Cp,gas | 281.60 | J/mol×K | 495.94 | Joback Calculated Property |
| Cp,gas | 292.60 | J/mol×K | 525.13 | Joback Calculated Property |
| Cp,gas | 303.14 | J/mol×K | 554.33 | Joback Calculated Property |
| Cp,gas | 313.23 | J/mol×K | 583.53 | Joback Calculated Property |
| Cp,gas | 322.87 | J/mol×K | 612.73 | Joback Calculated Property |
| η | [0.0002402; 0.0054593] | Pa×s | [220.49; 437.54] |
|
| η | 0.0054593 | Pa×s | 220.49 | Joback Calculated Property |
| η | 0.0022477 | Pa×s | 256.67 | Joback Calculated Property |
| η | 0.0011523 | Pa×s | 292.84 | Joback Calculated Property |
| η | 0.0006842 | Pa×s | 329.01 | Joback Calculated Property |
| η | 0.0004505 | Pa×s | 365.19 | Joback Calculated Property |
| η | 0.0003198 | Pa×s | 401.36 | Joback Calculated Property |
| η | 0.0002402 | Pa×s | 437.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-Hexene-1-ol, acetate.
Sources
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