Structure Database (LMSD)

Common Name
9-Methylhentriacontane
Systematic Name
9-Methylhentriacontane
Synonyms
LM ID
LMFA11000554
Formula
C32H66
Exact Mass
Calculate m/z
450.51645
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Hydrocarbons [FA11]

References

Comments
Pherobase Semiochemicals

String Representations

InChiKey (Click to copy)
SVXXXVZKBJDOAY-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C32H66/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-22-23-24-25-27-29-31-32(3)30-28-26-11-9-7-5-2/h32H,4-31H2,1-3H3
SMILES (Click to copy)
CCCCCCCCC(C)CCCCCCCCCCCCCCCCCCCCCC

Other Databases

PubChem CID
6430460

Calculated Physicochemical Properties

Heavy Atoms 32
Rings 0
Aromatic Rings 0
Rotatable Bonds 28
Van der Waals Molecular Volume 562.16
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 12.59
Molar Refractivity 149.79

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Created at
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Updated at
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