Structure Database (LMSD)

Common Name
Pentadecan-2-ol
Systematic Name
Pentadecan-2-ol
Synonyms
LM ID
LMFA05000526
Formula
C15H32O
Exact Mass
Calculate m/z
228.245315
Sum Composition
FOH 15:0
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

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

References

Comments
Pherobase Semiochemicals

String Representations

InChiKey (Click to copy)
ALVGHPMGQNBJRC-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(2)16/h15-16H,3-14H2,1-2H3
SMILES (Click to copy)
CC(O)CCCCCCCCCCCCC

Other Databases

CHEBI ID
197379
PubChem CID
96687

Calculated Physicochemical Properties

Heavy Atoms 16
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 276.85
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 5.35
Molar Refractivity 73.27

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Created at
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Updated at
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