Structure Database (LMSD)

Common Name
3-Methylpentacosane
Systematic Name
3-Methylpentacosane
Synonyms
LM ID
LMFA11000402
Status
Active
Exact Mass
Calculate m/z
366.42255
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)
VNSJCJLDAGMPAO-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C26H54/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(3)5-2/h26H,4-25H2,1-3H3
SMILES (Click to copy)
CCC(C)CCCCCCCCCCCCCCCCCCCCCC

References

Comments
Pherobase Semiochemicals

Other Databases

HMDB ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 26
Rings 0
Aromatic Rings 0
Rotatable Bonds 22
Van der Waals Molecular Volume 458.36
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 10.24
Molar Refractivity 122.09

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Created at
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Updated at
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