Structure Database (LMSD)

Common Name
13R,23S-Dimethylpentatriacontane
Systematic Name
13R,23S-Dimethylpentatriacontane
Synonyms
LM ID
LMFA11000018
Status
Active
Exact Mass
Calculate m/z
520.5947
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)
ZTXOMIYTNXPEFM-JXLNJXQWSA-N
InChi (Click to copy)
InChI=1S/C37H76/c1-5-7-9-11-13-15-17-20-24-28-32-36(3)34-30-26-22-19-23-27-31-35-37(4)33-29-25-21-18-16-14-12-10-8-6-2/h36-37H,5-35H2,1-4H3/t36-,37+
SMILES (Click to copy)
CCCCCCCCCCCC[C@@H](C)CCCCCCCCC[C@@H](C)CCCCCCCCCCCC

References

Comments
Pherobase Semiochemicals

Other Databases

PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 37
Rings 0
Aromatic Rings 0
Rotatable Bonds 32
Van der Waals Molecular Volume 648.66
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 14.39
Molar Refractivity 172.80

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Created at
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Updated at
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