Structure Database (LMSD)

Common Name
14-methyl-1-pentadecanol
Systematic Name
14-methyl-1-pentadecanol
Synonyms
  • 14-methyl-pentadecan-1-ol
LM ID
LMFA05000010
Formula
C16H34O
Exact Mass
Calculate m/z
242.260965
Sum Composition
FOH 16:0
Status
Curated
Show lipids differing only in stereochemistry/bond geometry
View MassBank spectra

Classification

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

String Representations

InChiKey (Click to copy)
CFSSWEQYBLCBLH-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H34O/c1-16(2)14-12-10-8-6-4-3-5-7-9-11-13-15-17/h16-17H,3-15H2,1-2H3
SMILES (Click to copy)
C(CCCC(C)C)CCCCCCCCCO

Other Databases

CHEBI ID
84910
PubChem CID
5283265

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 13
Van der Waals Molecular Volume 294.15
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 5.60
Molar Refractivity 77.82

Admin

Created at
-
Updated at
-