2465-32-9
Product Name:
1,3-DIOLEIN
Formula:
C39H72O5
Synonyms:
1,3-Di(cis-9-octadecenoyl)glycerol;ASTM D6584 1,3-Diolein Solution;Biodiesel impurity
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
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SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Flame Flammables GHS02 Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H225:Flammable liquids H302:Acute toxicity,oral H312:Acute toxicity,dermal H332:Acute toxicity,inhalation |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
COMPUTED DESCRIPTORS
Molecular Weight | 621.0 g/mol |
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XLogP3 | 14.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 36 |
Exact Mass | 620.53797539 g/mol |
Monoisotopic Mass | 620.53797539 g/mol |
Topological Polar Surface Area | 72.8 Ų |
Heavy Atom Count | 44 |
Formal Charge | 0 |
Complexity | 615 |
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
1,3-dioleoylglycerol is a 1,3-diglyceride with both acyl groups specified as oleoyl. It is a 1,3-diglyceride, a dioleoylglycerol and a diacylglycerol (18:1/0:0/18:1). It is functionally related to an oleic acid.