Structure Database (LMSD)
Common Name
Nerol
Systematic Name
Z-Geraniol
Synonyms
- (Z)-Geraniol
- (Z)-3,7-dimethylocta-2,6-dien-1-ol
- Neryl alcohol
3D model of Nerol
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)
GLZPCOQZEFWAFX-YFHOEESVSA-N
InChi (Click to copy)
InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7-
SMILES (Click to copy)
C(/C)(=C\CO)\CC/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
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Created at
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Updated at
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