Structure Database (LMSD)
Common Name
Ethylcyclohexane
Systematic Name
Ethylcyclohexane
Synonyms
3D model of Ethylcyclohexane
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
String Representations
InChiKey (Click to copy)
IIEWJVIFRVWJOD-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C8H16/c1-2-8-6-4-3-5-7-8/h8H,2-7H2,1H3
SMILES (Click to copy)
C1(CC)CCCCC1
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Nostoc sp.
(#1180)
Separation and identification of hydrocarbons and other volatile compounds from cultured blue-green alga Nostoc sp. by gas chromatography-mass spectrometry using serially coupled capillary columns with consecutive nonpolar and semipolar stationary phases.,
J Chromatogr A, 1999
J Chromatogr A, 1999
Pubmed ID:
10596980
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
8
Rings
1
Aromatic Rings
0
Rotatable Bonds
1
Van der Waals Molecular Volume
134.60
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
2.98
Molar Refractivity
36.87
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Updated at
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