Structure Database (LMSD)
Common Name
(-)-Linalool
Systematic Name
3R,7-dimethylocta-1,6-dien-3-ol
Synonyms
- (R)-3,7-dimethylocta-1,6-dien-3-ol
3D model of (-)-Linalool
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)
CDOSHBSSFJOMGT-JTQLQIEISA-N
InChi (Click to copy)
InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3/t10-/m0/s1
SMILES (Click to copy)
C[C@@](O)(CC/C=C(\C)/C)C=C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
11
Rings
0
Aromatic Rings
0
Rotatable Bonds
4
Van der Waals Molecular Volume
185.07
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
2.96
Molar Refractivity
50.00
Admin
Created at
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Updated at
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