OZONE
General Information
| Mainterm | OZONE |
| Doc Type | EAF |
| CAS Reg.No.(or other ID) | 10028-15-6 |
| Regnum |
173.368 184.1563 |
From www.fda.gov
Computed Descriptors
Download SDF| 2D Structure | |
| CID | 24823 |
| IUPAC Name | ozone |
| InChI | InChI=1S/O3/c1-3-2 |
| InChI Key | CBENFWSGALASAD-UHFFFAOYSA-N |
| Canonical SMILES | [O-][O+]=O |
| Molecular Formula | O3 |
| Wikipedia | ozone |
From Pubchem
Computed Properties
| Property Name | Property Value |
|---|---|
| Molecular Weight | 47.997 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Complexity | 4.8 |
| 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 Area | 41.1 |
| Monoisotopic Mass | 47.985 |
| Exact Mass | 47.985 |
| XLogP3 | None |
| XLogP3-AA | -1.7 |
| Compound Is Canonicalized | True |
| Formal Charge | 0 |
| Heavy Atom Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Isotope Atom Count | 0 |
| Covalently-Bonded Unit Count | 1 |
From Pubchem
Taxonomic Classification
| Kingdom | Inorganic compounds |
|---|---|
| Superclass | Homogeneous non-metal compounds |
| Class | Other non-metal organides |
| Subclass | Other non-metal oxides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Other non-metal oxides |
| Alternative Parents | |
| Molecular Framework | Not available |
| Substituents | Other non-metal oxide - Inorganic oxide |
| Description | This 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