- InChI
- InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h4-5,8H,2-3,6-7H2,1H3/b5-4-
- InChI Key
- SDZQUCJFTUULJX-PLNGDYQASA-N
- Formula
- C7H14O
- SMILES
- CCCC=CCCO
- Molecular Weight1
- 114.19
- CAS
- 1708-81-2
- Other Names
-
- cis-3-Hepten-1-ol
- (Z)-hept-3-en-1-ol
- 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 | 0.5915 | Relay (1.0) Calculated Property | |
| ΔfG° | -48.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -277.93 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 18.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.85 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.06 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.35 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.725 | Crippen Calculated Property | |
| McVol | 111.060 | ml/mol | McGowan Calculated Property |
| Pc | 3280.28 | kPa | Joback Calculated Property |
| Inp | [959.00; 989.00] |
|
|
| Inp | 959.00 | NIST | |
| Inp | 988.00 | NIST | |
| Inp | 989.00 | NIST | |
| Inp | 959.00 | NIST | |
| I | [1490.00; 1509.00] |
|
|
| I | 1490.00 | NIST | |
| I | 1491.00 | NIST | |
| I | 1509.00 | NIST | |
| I | 1491.00 | NIST | |
| Tboil | 446.04 | K | Relay (1.0) Calculated Property |
| Tc | 632.75 | K | Relay (1.0) Calculated Property |
| Tfus | 192.89 | K | Relay (1.0) Calculated Property |
| Vc | 0.406 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [231.56; 286.59] | J/mol×K | [456.10; 623.93] |
|
| Cp,gas | 231.56 | J/mol×K | 456.10 | Joback Calculated Property |
| Cp,gas | 241.78 | J/mol×K | 484.07 | Joback Calculated Property |
| Cp,gas | 251.56 | J/mol×K | 512.04 | Joback Calculated Property |
| Cp,gas | 260.92 | J/mol×K | 540.01 | Joback Calculated Property |
| Cp,gas | 269.86 | J/mol×K | 567.98 | Joback Calculated Property |
| Cp,gas | 278.42 | J/mol×K | 595.96 | Joback Calculated Property |
| Cp,gas | 286.59 | J/mol×K | 623.93 | Joback Calculated Property |
| η | [0.0001706; 0.0712349] | Pa×s | [224.39; 456.10] |
|
| η | 0.0712349 | Pa×s | 224.39 | Joback Calculated Property |
| η | 0.0124515 | Pa×s | 263.01 | Joback Calculated Property |
| η | 0.0034019 | Pa×s | 301.63 | Joback Calculated Property |
| η | 0.0012477 | Pa×s | 340.25 | Joback Calculated Property |
| η | 0.0005615 | Pa×s | 378.86 | Joback Calculated Property |
| η | 0.0002929 | Pa×s | 417.48 | Joback Calculated Property |
| η | 0.0001706 | Pa×s | 456.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Hepten-1-ol, (Z)-.
Sources
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