Methyl 14-methylhexadecanoate

Methyl 14-methylhexadecanoate
Compound Structure:
Synonyms: Methyl 14-methylhexadecanoate; Hexadecanoic acid, 14-methyl-, methyl ester; Methyl 14-methyl-8-hexadecenoate; METHYL14-METHYLHEXADECANOATE.
Compound ID: NMPC-1241
PubChem ID:

520159
Molecular Formula: C18H36O2
Canonical SMILES: CCC(C)CCCCCCCCCCCCC(=O)OC
InChIKey: AOAFVSVYRSUDBN-UHFFFAOYSA-N
About the compound:
Properties:

Chemical and Physical Properties

Computed Properties

Property Name

Property Value

Molecular Weight

284.5 g/mol

XLogP3-AA

7.7

Hydrogen Bond Donor Count

0

Hydrogen Bond Acceptor Count

2

Rotatable Bond Count

15

Exact Mass

284.271530387 g/mol

Monoisotopic Mass

284.271530387 g/mol

Topological Polar Surface Area

26.3Ų

Heavy Atom Count

20

Formal Charge

0

Complexity

214

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

1

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source: PubChem            
Source Species: Azanza garckeana
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