Structure database (LMSD)

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LM IDLMFA01010011
Common NameUndecylic acid
Systematic Nameundecanoic acid
SynonymsHendecanoic acid; C11:0
Exact Mass
186.1620 (neutral)    Calculate m/z:
FormulaC11H22O2
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassStraight chain fatty acids [FA0101]
LIPIDBANK IDDFA0011
PubChem CID8180
HMDB IDHMDB0000947
CHEBI ID32368
PlantFA ID10025
SWISSLIPIDS IDSLM:000389946
CAYMAN ID19721
InChIKeyZDPHROOEEOARMN-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C11H22O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2-10H2,1H3,(H,12,13)
SMILESC(C)CCCCCCCCC(=O)O
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms13Rings0Aromatic Rings0Rotatable Bonds9
 van der Waals
Molecular Volume
213.80Topological Polar
Surface Area
37.30Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
2
 logP3.60Molar
Refractivity
54.86