10-Thiaxanthenone,5-dioxide, oxime
Basic information
- CAS
5395-25-5- Standard SMILES
O=S1(=O)c2ccccc2C(=NO)c2ccccc21- InChIKey
MFVFIUCBCLRVGT-UHFFFAOYSA-N- Molecular formula
- C13H9NO3S
- Average molar mass
- 259.28 g/mol
- Monoisotopic mass
- 259.03031432
Names & identifiers
- Preferred name
- 10-Thiaxanthenone,5-dioxide, oxime
- IUPAC
- N-(10,10-dioxothioxanthen-9-ylidene)hydroxylamine
Names & synonyms
5395-25-5NSC268610-THIAXANTHENONE,5-DIOXIDE, OXIMECHEMBL2003450SCHEMBL17988357DTXSID20968754NSC-2686NCI60_0021729-(Hydroxyimino)-10lambda~6~-thioxanthene-10,10(9H)-dione
Database identifiers
- CAS
5395-25-5- PubChem CID
- 220231
- DTXSID
DTXSID20968754- ChEMBL
CHEMBL2003450
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 75.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 419
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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