Structure Database (LMSD)

Common Name
14-methyl-1-hexadecanol
Systematic Name
14-methyl-1-hexadecanol
Synonyms
  • 14-methyl-hexadecan-1-ol
LM ID
LMFA05000009
Status
Active
Exact Mass
Calculate m/z
256.276615
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

Category
Main Class
Sub Class

String Representations

InChiKey (Click to copy)
WQBUQCSTGAHNSM-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C17H36O/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18/h17-18H,3-16H2,1-2H3
SMILES (Click to copy)
C(CCCC(C)CC)CCCCCCCCCO

References

Other Databases

CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 18
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 311.45
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 5.99
Molar Refractivity 82.43

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Created at
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Updated at
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