General Information

MaintermOZONE
Doc TypeEAF
CAS Reg.No.(or other ID)10028-15-6
Regnum 173.368
184.1563

From www.fda.gov

Computed Descriptors

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2D Structure
CID24823
IUPAC Nameozone
InChIInChI=1S/O3/c1-3-2
InChI KeyCBENFWSGALASAD-UHFFFAOYSA-N
Canonical SMILES[O-][O+]=O
Molecular FormulaO3
Wikipediaozone

From Pubchem


Computed Properties

Property Name Property Value
Molecular Weight47.997
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Complexity4.8
CACTVS Substructure Key Fingerprint A A A D c Q A A M A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A B A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A = =
Topological Polar Surface Area41.1
Monoisotopic Mass47.985
Exact Mass47.985
XLogP3None
XLogP3-AA-1.7
Compound Is CanonicalizedTrue
Formal Charge0
Heavy Atom Count3
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Isotope Atom Count0
Covalently-Bonded Unit Count1

From Pubchem


Taxonomic Classification

KingdomInorganic compounds
SuperclassHomogeneous non-metal compounds
ClassOther non-metal organides
SubclassOther non-metal oxides
Intermediate Tree NodesNot available
Direct ParentOther non-metal oxides
Alternative Parents
Molecular FrameworkNot available
SubstituentsOther non-metal oxide - Inorganic oxide
DescriptionThis compound belongs to the class of inorganic compounds known as other non-metal oxides. These are inorganic compounds containing an oxygen atom of an oxidation state of -2, in which the heaviest atom bonded to the oxygen belongs to the class of 'other non-metals'.

From ClassyFire