N-(7-fluoro-3-methylsulfanyl-9-oxofluoren-2-yl)acetamide

HCID 269090

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Basic information

CAS: 16233-00-4
Standard SMILES: CSc1cc2c(cc1NC(C)=O)C(=O)c1cc(F)ccc1-2
InChIKey: AADTUGFUTDAKMX-UHFFFAOYSA-N
Molecular formula: C16H12FNO2S
Average molar mass: 301.3 g/mol
Monoisotopic mass: 301.05727796

Names & identifiers

Preferred name: N-(7-fluoro-3-methylsulfanyl-9-oxofluoren-2-yl)acetamide
IUPAC: N-(7-fluoro-3-methylsulfanyl-9-oxofluoren-2-yl)acetamide

Names & synonyms

16233-00-4N-(7-fluoro-3-methylsulfanyl-9-oxofluoren-2-yl)acetamideNSC109638n-[7-fluoro-3-(methylsulfanyl)-9-oxo-9h-fluoren-2-yl]acetamideDTXSID20296504NSC-109638

Database identifiers

CAS: 16233-00-4
PubChem CID: 269090
DTXSID: DTXSID20296504

Properties

Computed structural properties

XLogP: 2.8
Topological polar surface area: 71.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 21
Formal charge: 0
Complexity: 444

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