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Sigma-Aldrich

Methyl 12-oxooctadecanoate

98%

Synonym(s):

Methyl 12-ketostearate, Methyl 12-oxostearate

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About This Item

Linear Formula:
CH3(CH2)5CO(CH2)10CO2CH3
CAS Number:
2380-27-0
Molecular Weight:
312.49
MDL number:
MFCD00012224
UNSPSC Code:
12352100
PubChem Substance ID:
24858116
NACRES:
NA.22

Quality Level

100

Assay

98%

form

solid

bp

178-180 °C/0.8 mmHg (lit.)

mp

46-48 °C (lit.)

functional group

ester
ketone

SMILES string

CCCCCCC(=O)CCCCCCCCCCC(=O)OC

InChI

1S/C19H36O3/c1-3-4-5-12-15-18(20)16-13-10-8-6-7-9-11-14-17-19(21)22-2/h3-17H2,1-2H3

InChI key

XVSPEBNRFAFNAV-UHFFFAOYSA-N

Related Categories

General description

Methyl 12-oxooctadecanoate is a long chain keto fatty acid and its reaction with hydrazoic acid was studied.

Application

Methyl 12-oxooctadecanoate was used in preparation of methyl hexahydro-3-hexyl-6-thioxo-1,2,4,5-tetrazine-3-undecanoate, hexahydrothioxotetrazine fatty derivative, via reaction with thiocarbohydrazide.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
MKCD9523
MKBP1409V
10312PZ

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Derivatization of keto fatty acids: Part XIII-Synthesis of methyl hexahydro-3-alkyl-6-thioxo-1, 2, 4, 5-tetrazine-3-alkanoates.
Saeed MT, et al.
Journal of the American Oil Chemists' Society, 69(4), 396-397 (1992)
Derivatization of Keto Fatty Acids IV Reaction of Hydrazoic Acid on Long Chain Keto Acid Esters.
Ahmad F, et al.
European Journal of Lipid Science and Technology, 88(2), 62-65 (1986)
Michal Korinek et al.
Frontiers in pharmacology, 8, 356-356 (2017-07-05)
Increasing prevalence of allergic diseases with an inadequate variety of treatment drives forward search for new alternative drugs. Fatty acids, abundant in nature, are regarded as important bioactive compounds and powerful nutrients playing an important role in lipid homeostasis and

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