5-Amino-3-(2,2-diphenylethyl)-3H-1,2,3-oxadiazol-1-ium chloride
Basic information
- CAS
18430-27-8- Standard SMILES
Nc1c[n+](CC(c2ccccc2)c2ccccc2)no1.[Cl-]- InChIKey
GKMJFSLKSMFFMJ-UHFFFAOYSA-M- Molecular formula
- C16H16ClN3O
- Average molar mass
- 301.77 g/mol
- Monoisotopic mass
- 301.0981898
Names & identifiers
- Preferred name
- 5-Amino-3-(2,2-diphenylethyl)-3H-1,2,3-oxadiazol-1-ium chloride
- IUPAC
- 3-(2,2-diphenylethyl)oxadiazol-3-ium-5-amine chloride
Names & synonyms
18430-27-8DTXSID709398185-Amino-3-(2,2-diphenylethyl)-3H-1,2,3-oxadiazol-1-ium chlorideRefChem:1072621DTXCID1013683073-(beta,beta-Diphenylethyl)sydnonimine hydrochlorideSydnone imine, 3-(2,2-diphenylethyl)-, hydrochloride
Database identifiers
- CAS
18430-27-8- PubChem CID
- 205648
- DTXSID
DTXSID70939818
Properties
Computed structural properties
- Topological polar surface area
- 55.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 269
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Compound notes
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