Structure Database (LMSD)

Common Name
3-Methyltriacontane
Systematic Name
3-Methyltriacontane
Synonyms
LM ID
LMFA11000406
Formula
C31H64
Exact Mass
Calculate m/z
436.5008
Status
Curated
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)
NXCMTLDSKYDELZ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C31H64/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31(3)5-2/h31H,4-30H2,1-3H3
SMILES (Click to copy)
CCC(C)CCCCCCCCCCCCCCCCCCCCCCCCCCC

Other Databases

PubChem CID
14543656

Calculated Physicochemical Properties

Heavy Atoms 31
Rings 0
Aromatic Rings 0
Rotatable Bonds 27
Van der Waals Molecular Volume 544.86
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 12.19
Molar Refractivity 145.17

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Created at
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Updated at
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