Structure Database (LMSD)
Common Name
Myrcene
Systematic Name
Synonyms
3D model of Myrcene
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Level 4 Class
String Representations
InChiKey (Click to copy)
UAHWPYUMFXYFJY-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3
SMILES (Click to copy)
C(=C)(C=C)CC/C=C(/C)\C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
10
Rings
0
Aromatic Rings
0
Rotatable Bonds
4
Van der Waals Molecular Volume
173.64
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
3.48
Molar Refractivity
48.00
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Created at
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Updated at
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