Structure Database (LMSD)

Common Name
Nonan-2R-ol
Systematic Name
Nonan-2R-ol
Synonyms
LM ID
LMFA05000500
Formula
C9H20O
Exact Mass
Calculate m/z
144.151415
Sum Composition
FOH 9:0
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

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

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Rhyacophila nubila (#1876001)
Insecta (#50557)
Receptor neuron responses to potential sex pheromone components in the caddisfly Rhyacophila nubila (Trichoptera: Rhyacophilidae).,
J Insect Physiol, 1998
Pubmed ID: 12769891

String Representations

InChiKey (Click to copy)
NGDNVOAEIVQRFH-SECBINFHSA-N
InChi (Click to copy)
InChI=1S/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3/t9-/m1/s1
SMILES (Click to copy)
C[C@@H](O)CCCCCCC

Other Databases

CHEBI ID
178390
PubChem CID
11286536

Calculated Physicochemical Properties

Heavy Atoms 10
Rings 0
Aromatic Rings 0
Rotatable Bonds 6
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
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Updated at
6th Jan 2025