Structure Database (LMSD)

Common Name
Pentadecan-1-ol
Systematic Name
Pentadecan-1-ol
Synonyms
LM ID
LMFA05000194
Status
Active
Exact Mass
Calculate m/z
228.245315
Formula
Abbrev



Download as...
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

String Representations

InChiKey (Click to copy)
REIUXOLGHVXAEO-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h16H,2-15H2,1H3
SMILES (Click to copy)
OCCCCCCCCCCCCCCC

References

Comments
Pherobase

Other Databases

HMDB ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 16
Rings 0
Aromatic Rings 0
Rotatable Bonds 13
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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