9-Phenyl-9H-thioxanthen-9-ol 10,10-dioxide
Basic information
- CAS
6630-81-5- Standard SMILES
O=S1(=O)c2ccccc2C(O)(c2ccccc2)c2ccccc21- InChIKey
LBVZDBOJWNAZQS-UHFFFAOYSA-N- Molecular formula
- C19H14O3S
- Average molar mass
- 322.4 g/mol
- Monoisotopic mass
- 322.06636548
Names & identifiers
- Preferred name
- 9-Phenyl-9H-thioxanthen-9-ol 10,10-dioxide
- IUPAC
- 10,10-dioxo-9-phenylthioxanthen-9-ol
Names & synonyms
9-Phenyl-9H-thioxanthen-9-ol 10,10-dioxide6630-81-5NSC55806NSC 55806MLS002667777Thioxanthen-9-ol, 9-phenol-, 10,10-dioxideNSC-5580610,10-dioxo-9-phenylthioxanthen-9-olHMS3079J08GX4RCE2GT9NCIOpen2_007459CHEMBL1905233
Show more names
DTXSID30216516Thioxanthen-9-ol, 10,10-dioxide10,10-dioxo-9-phenyl-thioxanthen-9-olSMR0015575369H-Thioxanthen-9-ol, 9-phenyl-, 10,10-dioxide9-Hydroxy-9-phenyl-10lambda~6~-thioxanthene-10,10(9H)-dione
Database identifiers
- CAS
6630-81-5- PubChem CID
- 244708
- DTXSID
DTXSID30216516- ChEMBL
CHEMBL1905233- UNII
- GX4RCE2GT9
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 499
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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