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112-63-0

112-63-0 structural image
Product Name: METHYL LINOLEATE
Formula: C19H34O2
Synonyms: Linoleic acid methyl ester;Methyl cis,cis-9,12-octadecadienoate;Methyl linoleate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid
Boiling Point 373.00 to 374.00 °C. @ 760.00 mm Hg
Melting Point -35 °C
LogP 6.82
Collision Cross Section 187.2 Ų [M+H]+ [CCS Type: DT, Method: stepped-field]
Kovats Retention Index 2071 2087 2069 2070 2061 2066.9 2078 2092 2100 2077 2072 2083 2070 2082 2087 2070 2067 2090 2078 2100 2100 2073 2073

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H225:Flammable liquids
H304:Aspiration hazard
H315:Skin corrosion/irritation
H336:Specific target organ toxicity,single exposure; Narcotic effects
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P233:Keep container tightly closed.
P273:Avoid release to the environment.
P331:Do NOT induce vomiting.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.

COMPUTED DESCRIPTORS

Molecular Weight 294.5 g/mol
XLogP3 6.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 15
Exact Mass 294.255880323 g/mol
Monoisotopic Mass 294.255880323 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 279
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Methyl linoleate is a fatty acid methyl ester of linoleic acid. It has been isolated from Neolitsea daibuensis. It has a role as a plant metabolite. It is functionally related to a linoleic acid.

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Progress Life Sciences Pvt Ltd

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