Basic information
- CAS
5416-83-1- Standard SMILES
O=C(Sc1ccc2c(c1)C(=O)c1ccccc1-2)c1ccccc1- InChIKey
UFZUKRLWOKWYRC-UHFFFAOYSA-N- Molecular formula
- C20H12O2S
- Average molar mass
- 316.4 g/mol
- Monoisotopic mass
- 316.05580079
Names & identifiers
- Preferred name
- s-(9-Oxo-9h-fluoren-2-yl) benzenecarbothioate
- IUPAC
- S-(9-oxofluoren-2-yl) benzenecarbothioate
Names & synonyms
5416-83-1s-(9-oxo-9h-fluoren-2-yl) benzenecarbothioateNSC12359DTXSID30969111NSC-12359
Database identifiers
- CAS
5416-83-1- PubChem CID
- 224099
- DTXSID
DTXSID30969111
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 468
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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