1,2,4-Trioxolane, 3-phenyl-
Basic information
- CAS
23253-30-7- Standard SMILES
c1ccc(C2OCOO2)cc1- InChIKey
XNTUDDFWOBWITE-UHFFFAOYSA-N- Molecular formula
- C8H8O3
- Average molar mass
- 152.15 g/mol
- Monoisotopic mass
- 152.04734411
Names & identifiers
- Preferred name
- 1,2,4-Trioxolane, 3-phenyl-
- IUPAC
- 3-phenyl-1,2,4-trioxolane
- English name
- 3-Phenyl-1,2,4-trioxolane
- Molecular formula
- C8H8O3
- Molecular weight
- 152.15
Names & synonyms
3-Phenyl-1,2,4-trioxolane1,2,4-Trioxolane, 3-phenyl-Benzene, ethenyl-, ozonide23253-30-7DTXSID20341068RefChem:215317DTXCID40292149XNTUDDFWOBWITE-UHFFFAOYSA-NSCHEMBL9199192Ethenyl benzene ozonide
Database identifiers
- CAS
23253-30-7- PubChem CID
- 569760
- DTXSID
DTXSID20341068- Nikkaji
- J100.052G
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 121
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Compound notes
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