Structure database (LMSD)

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LM IDLMFA01050034
Common Name2-hydroxy hendecanoic acid
Systematic Name2-hydroxy-undecanoic acid
Synonyms-
Exact Mass
202.1569 (neutral)    Calculate m/z:
FormulaC11H22O3
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassHydroxy fatty acids [FA0105]
LIPIDBANK IDDFA0300
PubChem CID5282899
HMDB IDHMDB0059736
InChIKeyMNRBGFKCVTVNBA-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C11H22O3/c1-2-3-4-5-6-7-8-9-10(12)11(13)14/h10,12H,2-9H2,1H3,(H,13,14)
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SMILES
C(CCCCCCCC)C(O)C(=O)O
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms14Rings0Aromatic Rings0Rotatable Bonds9
 van der Waals
Molecular Volume
222.59Topological Polar
Surface Area
57.53Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
3
 logP2.86Molar
Refractivity
56.76