Structure Database (LMSD)

Common Name
Decan-3-ol
Systematic Name
Decan-3-ol
Synonyms
LM ID
LMFA05000510
Status
Active
Exact Mass
Calculate m/z
158.167065
Formula
C10H22O
Abbrev
FOH 10:0
Show lipids differing only in stereochemistry/bond geometry
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MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

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

String Representations

InChiKey (Click to copy)
ICEQLCZWZXUUIJ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C10H22O/c1-3-5-6-7-8-9-10(11)4-2/h10-11H,3-9H2,1-2H3
SMILES (Click to copy)
CCC(O)CCCCCCC

References

Comments
Pherobase Semiochemicals

Other Databases

HMDB ID
HMDB0031408
PubChem CID
519158

Calculated Physicochemical Properties

Heavy Atoms 11
Rings 0
Aromatic Rings 0
Rotatable Bonds 7
Van der Waals Molecular Volume 190.35
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 3.40
Molar Refractivity 50.19

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Updated at
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