- InChI
- InChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h6-7H,3-5,8-13H2,1-2H3/b7-6-
- InChI Key
- MUZGQHWTRUVFLG-SREVYHEPSA-N
- Formula
- C14H26O2
- SMILES
- CCCCC=CCCCCCCOC(C)=O
- Molecular Weight1
- 226.35
- CAS
- 14959-86-5
- Other Names
-
- (Z)-1-Acetoxy-7-dodecene
- (Z)-7-Dodecen-1-ol acetate
- (Z)-7-Dodecen-1-yl acetate
- (Z)-7-Dodecenyl acetate
- (Z)-dodec-7-enyl acetate
- 7-Dodecen-1-ol, acetate, (7Z)-
- 7-Dodecen-1-ol, acetate, (Z)-
- Looplure
- acetic acid dodec-7-enyl ester, cis
- cis-1-Acetoxy-7-dodecene
- cis-7-Dodecen-1-ol acetate
- cis-7-Dodecenyl acetate
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- 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° | -86.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -459.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.80 | kJ/mol | NIST |
| log10WS | -4.40 | Crippen Calculated Property | |
| logPoct/wat | 4.246 | Crippen Calculated Property | |
| McVol | 211.260 | ml/mol | McGowan Calculated Property |
| Pc | 1647.09 | kPa | Joback Calculated Property |
| Inp | [1575.00; 1598.00] |
|
|
| Inp | 1598.00 | NIST | |
| Inp | 1575.00 | NIST | |
| Inp | 1598.00 | NIST | |
| I | [1911.00; 1973.00] |
|
|
| I | 1911.00 | NIST | |
| I | 1973.00 | NIST | |
| I | 1968.00 | NIST | |
| I | 1929.00 | NIST | |
| I | 1911.00 | NIST | |
| I | 1973.00 | NIST | |
| I | 1929.00 | NIST | |
| Tboil | 600.17 | K | Joback Calculated Property |
| Tc | 774.06 | K | Joback Calculated Property |
| Tfus | 314.62 | K | Joback Calculated Property |
| Vc | 0.824 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [547.45; 636.08] | J/mol×K | [600.17; 774.06] |
|
| Cp,gas | 547.45 | J/mol×K | 600.17 | Joback Calculated Property |
| Cp,gas | 563.96 | J/mol×K | 629.15 | Joback Calculated Property |
| Cp,gas | 579.75 | J/mol×K | 658.13 | Joback Calculated Property |
| Cp,gas | 594.83 | J/mol×K | 687.12 | Joback Calculated Property |
| Cp,gas | 609.24 | J/mol×K | 716.10 | Joback Calculated Property |
| Cp,gas | 622.98 | J/mol×K | 745.08 | Joback Calculated Property |
| Cp,gas | 636.08 | J/mol×K | 774.06 | Joback Calculated Property |
| η | [0.0001309; 0.0025872] | Pa×s | [314.62; 600.17] |
|
| η | 0.0025872 | Pa×s | 314.62 | Joback Calculated Property |
| η | 0.0011349 | Pa×s | 362.21 | Joback Calculated Property |
| η | 0.0006028 | Pa×s | 409.80 | Joback Calculated Property |
| η | 0.0003653 | Pa×s | 457.40 | Joback Calculated Property |
| η | 0.0002432 | Pa×s | 504.99 | Joback Calculated Property |
| η | 0.0001737 | Pa×s | 552.58 | Joback Calculated Property |
| η | 0.0001309 | Pa×s | 600.17 | Joback Calculated Property |
| ΔvapH | 77.50 | kJ/mol | 310.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [390.40; 593.93] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.28805e+01 | |||
| Coefficient B | -3.86144e+03 | |||
| Coefficient C | -8.37640e+01 | |||
| Temperature range, min. | 390.40 | |||
| Temperature range, max. | 593.93 | |||
| Pvap | 1.33 | kPa | 390.40 | Calculated Property |
| Pvap | 3.17 | kPa | 413.01 | Calculated Property |
| Pvap | 6.73 | kPa | 435.63 | Calculated Property |
| Pvap | 13.05 | kPa | 458.24 | Calculated Property |
| Pvap | 23.48 | kPa | 480.86 | Calculated Property |
| Pvap | 39.65 | kPa | 503.47 | Calculated Property |
| Pvap | 63.47 | kPa | 526.09 | Calculated Property |
| Pvap | 97.05 | kPa | 548.70 | Calculated Property |
| Pvap | 142.66 | kPa | 571.32 | Calculated Property |
| Pvap | 202.66 | kPa | 593.93 | Calculated Property |
Similar Compounds
Find more compounds similar to cis-7-Dodecen-1-yl acetate.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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