Structure Database (LMSD)

OH
Common Name
(R)-Sulcatol
Systematic Name
6-methylhept-5-en-2-ol
Synonyms
LM ID
LMFA05000566
Formula
Exact Mass
Calculate m/z
128.120115
Sum Composition
Status
Active

Main

Classification

Category
Main Class
Sub Class

String Representations

InChiKey (Click to copy)
OHEFFKYYKJVVOX-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C8H16O/c1-7(2)5-4-6-8(3)9/h5,8-9H,4,6H2,1-3H3
SMILES (Click to copy)
C/C(/C)=C/CCC(C)O

References

Other Databases

KEGG ID
HMDB ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 9
Rings 0
Aromatic Rings 0
Rotatable Bonds 3
Van der Waals Molecular Volume 153.11
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 2.40
Molar Refractivity 40.86

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Created at
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Updated at
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