Structure Database (LMSD)

Common Name
9-dodecen-1-ol
Systematic Name
9-dodecen-1-ol
Synonyms
  • dodeca-9-en-1-ol
LM ID
LMFA05000024
Formula
C12H24O
Exact Mass
Calculate m/z
184.182715
Sum Composition
FOH 12:1
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty alcohols [FA05]

String Representations

InChiKey (Click to copy)
GJNNIRNIXNLOJP-ONEGZZNKSA-N
InChi (Click to copy)
InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h3-4,13H,2,5-12H2,1H3/b4-3+
SMILES (Click to copy)
C(/CC)=C\CCCCCCCCO

References

Other Databases

CHEBI ID
165512
PubChem CID
5283277

Calculated Physicochemical Properties

Heavy Atoms 13
Rings 0
Aromatic Rings 0
Rotatable Bonds 9
Van der Waals Molecular Volume 222.31
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 3.96
Molar Refractivity 59.33

Reactions

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Reactions graph legend

Admin

Created at
-
Updated at
25th Apr 2022