Structure database (LMSD)

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LM IDLMFA01100010
Common Name9-amino-nonanoic acid
Systematic Name9-amino-nonanoic acid
Synonyms-
Exact Mass
173.1416 (neutral)    Calculate m/z:
FormulaC9H19NO2
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassAmino fatty acids [FA0110]
LIPIDAT ID2310
PubChem CID136877
CHEBI ID73740
InChIKeyVWPQCOZMXULHDM-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C9H19NO2/c10-8-6-4-2-1-3-5-7-9(11)12/h1-8,10H2,(H,11,12)
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SMILES
C(CCCCCCCCN)(=O)O
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms12Rings0Aromatic Rings0Rotatable Bonds8
 van der Waals
Molecular Volume
190.20Topological Polar
Surface Area
63.32Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
2
 logP2.05Molar
Refractivity
49.50