Structure Database (LMSD)

Common Name
(E)-10-Oxo-8-decenoic acid
Systematic Name
(8E)-10-oxodec-8-enoic acid
Synonyms
LM ID
LMFA01030949
Formula
Exact Mass
Calculate m/z
184.109945
Sum Composition
Status
Active

Classification

String Representations

InChiKey (Click to copy)
YUAQBOMIASXPQW-FNORWQNLSA-N
InChi (Click to copy)
InChI=1S/C10H16O3/c11-9-7-5-3-1-2-4-6-8-10(12)13/h5,7,9H,1-4,6,8H2,(H,12,13)/b7-5+
SMILES (Click to copy)
O=C/C=C/CCCCCCC(=O)O

Other Databases

HMDB ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 13
Rings 0
Aromatic Rings 0
Rotatable Bonds 8
Van der Waals Molecular Volume 200.01
Topological Polar Surface Area 54.37
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
logP 2.17
Molar Refractivity 50.54

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Created at
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Updated at
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