Structure Database (LMSD)

Common Name
1-Nonanol
Systematic Name
nonan-1-ol
Synonyms
  • 1-Hydroxynonane
  • 1-Nonanol
  • NONAN-1-OL
  • Nonylalkohol
  • Pelargonalkohol
  • n-Nonyl alcohol
  • n-nonanol
  • nonalol
  • nonyl alcohol
  • octyl carbinol
  • pelargonic alcohol
LM ID
LMFA05000092
Formula
C9H20O
Exact Mass
Calculate m/z
144.151415
Sum Composition
FOH 9:0
Status
Active
Show lipids differing only in stereochemistry/bond geometry
View MassBank spectra

Classification

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

Reactions

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ⓘ Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
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Reactions graph legend

String Representations

InChiKey (Click to copy)
ZWRUINPWMLAQRD-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C9H20O/c1-2-3-4-5-6-7-8-9-10/h10H,2-9H2,1H3
SMILES (Click to copy)
CCCCCCCCCO

Other Databases

Wikipedia
1-Nonanol
KEGG ID
C14696
HMDB ID
HMDB0031265
CHEBI ID
35986
PubChem CID
8914
PDB ID
F09

Calculated Physicochemical Properties

Heavy Atoms 10
Rings 0
Aromatic Rings 0
Rotatable Bonds 7
Van der Waals Molecular Volume 173.05
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 3.01
Molar Refractivity 45.57

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Created at
-
Updated at
25th Apr 2022