7,8-Dioxononanoic acid structure

7,8-Dioxononanoic acid

7,8-dioxononanoic acid

Also Known As: 7,8-dioxononanoic acid|7,8-diketopelargonic acid|zeta-eta-Dioxo-pelargonic acid

CAS: 7180-76-9
Molecular Formula C9H14O4
Molecular Weight 186.0892 g/mol
LogP 0.3
Topological Polar Surface Area 71.4 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 7
Exact Mass 186.0892
Monoisotopic Mass 186.0892
Heavy Atoms 13
Complexity 208.0

Chemical Identifiers

CAS Number 7180-76-9
SMILES CC(=O)C(=O)CCCCCC(=O)O
InChIKey LUCODFUPVSYZRC-UHFFFAOYSA-N

Product Overview

7,8-Dioxononanoic acid (CAS 7180-76-9), with molecular formula C9H14O4 and molecular weight 186.0892 g/mol. IUPAC: 7,8-dioxononanoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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