- InChI
- InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8,10-11H,3,6,9,12-18H2,1-2H3/b5-4-,8-7-,11-10-
- InChI Key
- DVWSXZIHSUZZKJ-YSTUJMKBSA-N
- Formula
- C19H32O2
- SMILES
- CCC=CCC=CCC=CCCCCCCCC(=O)OC
- Molecular Weight1
- 292.46
- CAS
- 301-00-8
- Other Names
-
- (Z,Z,Z)-9,12,15-Octadecatrienoic acid, methyl ester
- Methyl all-cis-9,12,15-octadecatrienoate
- Methyl linolenate, «alpha»
- Methyl «alpha»-linolenate
- [Z,Z,Z]-9,12,15-Octadecadienoic acid methyl ester
- cis,cis,cis-9,12,15-Octadecatrienoic acid, methyl ester
- linolenic acid, methyl ester
- methyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate
- methyl (Z,Z,Z)-9,12,15-octadecatrienoate
- methyl linolenate
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°liquid : Liquid phase 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).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- csound,fluid : Speed of sound in fluid (m/s).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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.
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry.
Do not hesitate to contact us for your projects.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔcH°liquid | -11506.00 ± 1.50 | kJ/mol | NIST |
| ΔfG° | 115.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -328.63 | kJ/mol | Joback Calculated Property |
| ΔfH°liquid | -492.75 | kJ/mol | NIST |
| ΔfusH° | 48.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [102.10; 110.50] | kJ/mol |
|
| ΔvapH° | 110.50 ± 0.50 | kJ/mol | NIST |
| ΔvapH° | 102.10 | kJ/mol | NIST |
| log10WS | -6.20 | Crippen Calculated Property | |
| logPoct/wat | 5.749 | Crippen Calculated Property | |
| McVol | 273.110 | ml/mol | McGowan Calculated Property |
| Pc | 1239.83 | kPa | Joback Calculated Property |
| Inp | [2047.00; 2125.00] |
|
|
| Inp | 2071.80 | NIST | |
| Inp | 2078.00 | NIST | |
| Inp | 2092.00 | NIST | |
| Inp | 2079.00 | NIST | |
| Inp | 2058.00 | NIST | |
| Inp | 2108.00 | NIST | |
| Inp | 2105.40 | NIST | |
| Inp | 2077.00 | NIST | |
| Inp | 2101.00 | NIST | |
| Inp | 2098.00 | NIST | |
| Inp | 2073.00 | NIST | |
| Inp | 2069.00 | NIST | |
| Inp | 2084.00 | NIST | |
| Inp | 2078.00 | NIST | |
| Inp | 2081.00 | NIST | |
| Inp | 2089.00 | NIST | |
| Inp | 2076.00 | NIST | |
| Inp | 2073.00 | NIST | |
| Inp | 2113.00 | NIST | |
| Inp | 2100.00 | NIST | |
| Inp | Outlier 2125.00 | NIST | |
| Inp | 2098.00 | NIST | |
| Inp | 2096.00 | NIST | |
| Inp | 2081.00 | NIST | |
| Inp | 2099.00 | NIST | |
| Inp | 2096.00 | NIST | |
| Inp | 2073.00 | NIST | |
| Inp | 2098.00 | NIST | |
| Inp | 2082.00 | NIST | |
| Inp | 2099.00 | NIST | |
| Inp | 2098.00 | NIST | |
| Inp | 2078.00 | NIST | |
| Inp | 2078.00 | NIST | |
| Inp | 2108.00 | NIST | |
| Inp | 2098.00 | NIST | |
| Inp | Outlier 2047.00 | NIST | |
| Inp | 2081.00 | NIST | |
| Inp | 2098.00 | NIST | |
| Inp | 2095.00 | NIST | |
| Inp | 2080.00 | NIST | |
| Inp | 2058.00 | NIST | |
| I | [2508.00; 2590.00] |
|
|
| I | 2590.00 | NIST | |
| I | Outlier 2508.00 | NIST | |
| I | 2583.00 | NIST | |
| I | 2583.00 | NIST | |
| I | 2550.00 | NIST | |
| I | 2558.00 | NIST | |
| I | 2590.00 | NIST | |
| Tboil | 722.89 | K | Joback Calculated Property |
| Tc | 904.64 | K | Joback Calculated Property |
| Tfus | 360.81 | K | Joback Calculated Property |
| Vc | 1.063 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [780.46; 875.18] | J/mol×K | [722.89; 904.64] |
|
|
T(K) Ideal gas heat capacity (J/mol×K) 780 800 820 840 860 880 750 800 850 900 | ||||
| Cp,gas | 780.46 | J/mol×K | 722.89 | Joback Calculated Property |
| Cp,gas | 798.24 | J/mol×K | 753.18 | Joback Calculated Property |
| Cp,gas | 815.15 | J/mol×K | 783.47 | Joback Calculated Property |
| Cp,gas | 831.25 | J/mol×K | 813.77 | Joback Calculated Property |
| Cp,gas | 846.59 | J/mol×K | 844.06 | Joback Calculated Property |
| Cp,gas | 861.21 | J/mol×K | 874.35 | Joback Calculated Property |
| Cp,gas | 875.18 | J/mol×K | 904.64 | Joback Calculated Property |
| η | [0.0012527; 0.0063612] | Pa×s | [278.15; 373.15] |
|
|
T(K) Dynamic viscosity (Pa×s) 1.00e-3 2.00e-3 3.00e-3 4.00e-3 5.00e-3 6.00e-3 300 350 | ||||
| η | 0.0063612 | Pa×s | 278.15 | Densiti... |
| η | 0.0056183 | Pa×s | 283.15 | Densiti... |
| η | 0.0050032 | Pa×s | 288.15 | Densiti... |
| η | 0.0044844 | Pa×s | 293.15 | Densiti... |
| η | 0.0040220 | Pa×s | 293.15 | Group C... |
| η | 0.0040429 | Pa×s | 298.15 | Densiti... |
| η | 0.0036665 | Pa×s | 303.15 | Densiti... |
| η | 0.0033010 | Pa×s | 303.15 | Group C... |
| η | 0.0033405 | Pa×s | 308.15 | Densiti... |
| η | 0.0029253 | Pa×s | 313.15 | Densiti... |
| η | 0.0027900 | Pa×s | 313.15 | Group C... |
| η | 0.0026750 | Pa×s | 318.15 | Densiti... |
| η | 0.0024725 | Pa×s | 323.15 | Densiti... |
| η | 0.0022990 | Pa×s | 323.15 | Group C... |
| η | 0.0023030 | Pa×s | 328.15 | Densiti... |
| η | 0.0018620 | Pa×s | 333.15 | Group C... |
| η | 0.0021234 | Pa×s | 333.15 | Densiti... |
| η | 0.0019659 | Pa×s | 338.15 | Densiti... |
| η | 0.0018165 | Pa×s | 343.15 | Densiti... |
| η | 0.0015960 | Pa×s | 343.15 | Group C... |
| η | 0.0016878 | Pa×s | 348.15 | Densiti... |
| η | 0.0015827 | Pa×s | 353.15 | Densiti... |
| η | 0.0014877 | Pa×s | 358.15 | Densiti... |
| η | 0.0014021 | Pa×s | 363.15 | Densiti... |
| η | 0.0013272 | Pa×s | 368.15 | Densiti... |
| η | 0.0012527 | Pa×s | 373.15 | Densiti... |
| ΔvapH | [87.70; 110.50] | kJ/mol | [298.15; 426.50] |
|
| ΔvapH | 110.50 | kJ/mol | 298.15 | the vap... |
| ΔvapH | 87.70 | kJ/mol | 426.50 | NIST |
| csound,fluid | [1272.00; 1485.00] | m/s | [278.15; 338.15] |
|
|
T(K) Speed of sound in fluid (m/s) 1300 1350 1400 1450 1500 280 300 320 | ||||
| csound,fluid | 1485.00 | m/s | 278.15 | Density... |
| csound,fluid | 1448.00 | m/s | 288.15 | Density... |
| csound,fluid | 1411.00 | m/s | 298.15 | Density... |
| csound,fluid | 1375.00 | m/s | 308.15 | Density... |
| csound,fluid | 1340.00 | m/s | 318.15 | Density... |
| csound,fluid | 1306.00 | m/s | 328.15 | Density... |
| csound,fluid | 1272.00 | m/s | 338.15 | Density... |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 455.20 | K | 0.40 | NIST |
Similar Compounds
Find more compounds similar to 9,12,15-Octadecatrienoic acid, methyl ester, (Z,Z,Z)-.
Sources
- Crippen Method
- Crippen Method
- the vaporization enthaplies and vapor pressures of a series of unstaurated fatty acid methyl esters by correlation gas chromatography
- Densities and Viscosities of Minority Fatty Acid Methyl and Ethyl Esters Present in Biodiesel
- Group Contribution Model for Predicting Viscosity of Fatty Compounds
- Density and Speed of Sound Measurements on Five Fatty Acid Methyl Esters at 83 kPa and Temperatures from (278.15 to 338.15) K
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
Take the time to validate and double check the source of the data.
Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.