Structure Database (LMSD)

Common Name
pentadecane
Systematic Name
pentadecane
Synonyms
  • n-pentadecane
LM ID
LMFA11000006
Status
Active
Exact Mass
Calculate m/z
212.2504
Formula



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)
YCOZIPAWZNQLMR-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H32/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3-15H2,1-2H3
SMILES (Click to copy)
C(CCCCCCC)CCCCCCC

References

Other Databases

Wikipedia
KEGG ID
HMDB ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 15
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 268.06
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 6.10
Molar Refractivity 71.37

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Created at
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Updated at
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