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Methyl Oleate

Catalog Number
ACM112629-3
Product Name
Methyl Oleate
Structure
CAS
112-62-9
Category
Plastic Additives
Synonyms
Cis-9-octadecenoic methyl ester
Description
Oleic acid methyl ester is a clear to amber liquid. Insoluble in water. (NTP, 1992);Liquid
IUPAC Name
Methyl (Z)-octadec-9-enoate
Molecular Weight
296.5
Molecular Formula
C19H36O2
Canonical SMILES
CCCCCCCCC=CCCCCCCCC(=O)OC
InChI
InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h10-11H,3-9,12-18H2,1-2H3/b11-10-
InChI Key
QYDYPVFESGNLHU-KHPPLWFESA-N
Boiling Point
218 °C
Melting Point
-20 °C
Flash Point
>230 °F
Purity
95%+
Density
0.874 g/mL at 20 °C(lit.)
Solubility
Insoluble (NTP, 1992);Insol in water; miscible with ethyl alcohol, ether; sol in chloroform
Appearance
Light yellow clear liquid
Color/Form
Colorless to amber clear liquid
Complexity
246
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
1
EC Number
203-992-5;262-969-8;219-559-9
Exact Mass
296.271530387
Formal Charge
0
Heat of Vaporization
20.17 kcal/mol at 1 torr
Heavy Atom Count
21
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Log P
7.45 (LogP);log Kow= 7.45
MeSH Entry Terms
9-octadecenoic acid, methyl ester, (9E)-;methyl elaidate;methyl oleate;methyl oleate, (E)-isomer;oleic acid methyl ester
Monoisotopic Mass
296.271530387
NSC Number
406282
Odor
Faint fatty odor
Other Experimental
Boiling point - 217 °C at 16 torr (decomposes);Standard heat of formation = -173.91 kcal/mol at 25 °C
Packaging
1 kg
Refractive Index
n20/D 1.452(lit.)
Rotatable Bond Count
16
Stability
Stable, but air and light sensitive. Incompatible with strong oxidizing agents. Combustible.
Storage Conditions
-20 °C
Topological Polar Surface Area
26.3 Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
UNII
39736AJ06R
Vapor Pressure
6.29e-06 mmHg;6.29X10-6 at 25 °C
Viscosity
Viscosity coefficients = 4.88, 2.62, and 1.64 cP at 30, 60, and 90 °C, respectively
XLogP3
7.6
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