Structure Database (LMSD)

Common Name
3-Methylpentadecane
Systematic Name
3-Methylpentadecane
Synonyms
LM ID
LMFA11000403
Formula
C16H34
Exact Mass
Calculate m/z
226.266051
Status
Curated
Show lipids differing only in stereochemistry/bond geometry
View NP-MRD ID(NMR) spectrum

Classification

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

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Polyrhachis (#84544)
Insecta (#50557)
Volatile constituents of two species of Australian formicine ants of the genera Notoncus and Polyrhachis,
Insect Biochem, 1982

String Representations

InChiKey (Click to copy)
FWXKCXJPHSAYMK-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H34/c1-4-6-7-8-9-10-11-12-13-14-15-16(3)5-2/h16H,4-15H2,1-3H3
SMILES (Click to copy)
CCC(C)CCCCCCCCCCCC

Other Databases

CHEBI ID
191242
PubChem CID
17899

Calculated Physicochemical Properties

Heavy Atoms 16
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 285.36
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 6.34
Molar Refractivity 75.92

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Created at
-
Updated at
17th Nov 2025