Structure Database (LMSD)

Common Name
heptadecane
Systematic Name
heptadecane
Synonyms
  • n-Heptadecane
LM ID
LMFA11000003
Status
Active
Exact Mass
Calculate m/z
240.2817
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)
NDJKXXJCMXVBJW-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3
SMILES (Click to copy)
C(CCCCCCCC)CCCCCCCC

References

Other Databases

Wikipedia
KEGG ID
HMDB ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 302.66
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 6.88
Molar Refractivity 80.60

Admin

Created at
-
Updated at
-