Structure Database (LMSD)

Common Name
Methyl hexadecanoate
Systematic Name
Methyl hexadecanoate
Synonyms
  • WE(1:0/16:0)
LM ID
LMFA07010470
Status
Active
Exact Mass
Calculate m/z
270.25588
Formula
Abbrev



Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
FLIACVVOZYBSBS-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C17H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h3-16H2,1-2H3
SMILES (Click to copy)
O=C(CCCCCCCCCCCCCCC)OC

References

Comments
Pherobase Semiochemicals

Other Databases

KEGG ID
HMDB ID
CHEBI ID
PubChem CID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 0
Aromatic Rings 0
Rotatable Bonds 15
Van der Waals Molecular Volume 317.60
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 5.64
Molar Refractivity 82.33

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Created at
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Updated at
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