Structure Database (LMSD)
Common Name
2,2,6,8-Tetramethylnonane
Systematic Name
2,2,6,8-Tetramethylnonane
Synonyms
3D model of 2,2,6,8-Tetramethylnonane
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Microcoleus vaginatus
(#119532)
Cyanophyceae
(#3028117)
[Branched alkanes and other apolar compounds produced by the cyanobacterium Microcoleus vaginatus from the Negev desert],
Bioorg Khim, 2001
Bioorg Khim, 2001
Pubmed ID:
11357397
String Representations
InChiKey (Click to copy)
BBGQBCBGXRNUHM-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C13H28/c1-11(2)10-12(3)8-7-9-13(4,5)6/h11-12H,7-10H2,1-6H3
SMILES (Click to copy)
CC(C)(C)CCCC(C)CC(C)C
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
13
Rings
0
Aromatic Rings
0
Rotatable Bonds
6
Van der Waals Molecular Volume
233.46
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
4.89
Molar Refractivity
61.93
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Updated at
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