Structure Database (LMSD)
Common Name
1-Ethyl-1,3-dimethyl-cyclohexane skeleton
Systematic Name
Synonyms
LM ID
LMPR0102050000
Status
Active
3D model of 1-Ethyl-1,3-dimethyl-cyclohexane skeleton
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
Level 4 Class
String Representations
InChiKey (Click to copy)
YLZKVXHQMPWDBJ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C10H20/c1-4-10(3)7-5-6-9(2)8-10/h9H,4-8H2,1-3H3
SMILES (Click to copy)
C1(C)CC(C)(CC)CCC1
References
Calculated Physicochemical Properties
Heavy Atoms
10
Rings
1
Aromatic Rings
0
Rotatable Bonds
1
Van der Waals Molecular Volume
169.20
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
3.61
Molar Refractivity
46.03
Admin
Created at
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Updated at
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