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14-methyl Palmitic Acid methyl ester

CAT: 0931-T85260-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T85260-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2490-49-5
Target
Others
Related Pathways
Others
Bioactivity
14-Methyl palmitic acid methyl ester is a methylated fatty acid methyl ester identified in A. indica leaf extract, S. alboflavus TD-1, and as a less prominent constituent in biodiesel from C. sorokiniana microalgae. It acts as a volatile agent emanating from maize, impeding the growth of F. verticillioides in a dose-responsive manner. Additionally, this compound is utilized as a reference standard for quantifying 14-methyl palmitic acid in diverse foods via GC-MS. [Matreya, LLC. Catalog No. 1614]
Smiles
C(CCCCCCCCCCCCC(OC)=O)(CC)C
Molecular Formula
C18H36O2
Molecular Weight
284.48
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Methyl 14-methylhexadecanoate

Methyl 14-methyl-8-hexadecenoate is a fatty acid methyl ester.

CAS Number2490-49-5
PubChem CID520159
IUPAC Namemethyl 14-methylhexadecanoate
Molecular FormulaC18H36O2
Molecular Weight284.5
XLogP7.7
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count15
Heavy Atom Count20
Formal Charge0
Complexity213
SMILES
CCC(C)CCCCCCCCCCCCC(=O)OC
InChI
InChI=1S/C18H36O2/c1-4-17(2)15-13-11-9-7-5-6-8-10-12-14-16-18(19)20-3/h17H,4-16H2,1-3H3
InChIKey
AOAFVSVYRSUDBN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl 14-methylhexadecanoate
CAS: 2490-49-5
CID: 520159
Formula: C18H36O2
MW: 284.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight284.5
XLogP37.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count15
Exact Mass284.271530387
Monoisotopic Mass284.271530387
Topological Polar Surface Area26.3 Ų
Heavy Atom Count20
Formal Charge0
Complexity213
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

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GTR19232176-0114-methyl Palmitic Acid methyl ester
GTR19232160-012-fluoro Palmitic Acid methyl ester
MBS57985143-hydroxy Palmitic Acid methyl ester
sc-205423Palmitic Acid ethyl ester
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