Spiro[1,3-dithiane-2,9'-fluorene]

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Basic information

CAS: 165-06-0
Standard SMILES: c1ccc2c(c1)-c1ccccc1C21SCCCS1
InChIKey: JXGJIOSBTJQIIG-UHFFFAOYSA-N
Molecular formula: C16H14S2
Average molar mass: 270.4 g/mol
Monoisotopic mass: 270.05369279

Names & identifiers

Preferred name: Spiro[1,3-dithiane-2,9'-fluorene]
IUPAC: spiro[1,3-dithiane-2,9'-fluorene]

Names & synonyms

spiro[1,3-dithiane-2,9'-fluorene]Spiro[[1,3]dithiane-2,9'-fluorene]165-06-0Spiro[fluorene-9,2'-(1,3)-dithiane]DTXSID90345811JXGJIOSBTJQIIG-UHFFFAOYSA-NAKOS024283358ST066710

Database identifiers

CAS: 165-06-0
PubChem CID: 607268
DTXSID: DTXSID90345811
Nikkaji: J718.875G

Properties

Computed structural properties

XLogP: 4.5
Topological polar surface area: 50.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 18
Formal charge: 0
Complexity: 284

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Compound notes

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