Structure Database (LMSD)

Common Name
tridecane
Systematic Name
tridecane
Synonyms
LM ID
LMFA11000001
Formula
C13H28
Exact Mass
Calculate m/z
184.2191
Status
Active
Show lipids differing only in stereochemistry/bond geometry
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Classification

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

String Representations

InChiKey (Click to copy)
IIYFAKIEWZDVMP-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C13H28/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-13H2,1-2H3
SMILES (Click to copy)
CCCCCCCCCCCCC

Other Databases

Wikipedia
tridecane
KEGG ID
C13834
HMDB ID
HMDB0034284
CHEBI ID
35998
PubChem CID
12388
PDB ID
TRD

Calculated Physicochemical Properties

Heavy Atoms 13
Rings 0
Aromatic Rings 0
Rotatable Bonds 10
Van der Waals Molecular Volume 233.46
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 5.32
Molar Refractivity 62.14

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Created at
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Updated at
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