Basic information
- CAS
5687-22-9- Standard SMILES
O=[As]1(O)c2ccccc2-c2ccccc21- InChIKey
YWUSKINSBWPHGO-UHFFFAOYSA-N- Molecular formula
- C12H9AsO2
- Average molar mass
- 260.12 g/mol
- Monoisotopic mass
- 259.981849
Names & identifiers
- Preferred name
- 5H-Benz(b)arsindole, 5-hydroxy-, 5-oxide
- IUPAC
- 5-hydroxybenzo[b]arsindole 5-oxide
- English name
- 5-Hydroxy-5H-dibenzarsole 5-oxide
- Molecular weight
- 0
Names & synonyms
Arsafluorinic acidDibenzarsenolic acid5687-22-9Dibenzarsenole, 5-hydroxy-, 5-oxide5H-Dibenzarsole, 5-hydroxy-, 5-oxideE88VR4W4AU5H-Benz(b)arsindole, 5-hydroxy-, 5-oxideNSC-10865DTXSID60205397RefChem:1073408DTXCID601278889-Arsafluoreninic acid
Show more names
9-Hydroxy-9-arsa-9H-fluorene 9-oxide
MLS000737934NSC108655-hydroxybenzo[b]arsindole 5-oxideNSC 10865BRN 01536795-Hydroxy-5H-dibenzarsole 5-oxideDibenzarsenole, 5-oxideUNII-E88VR4W4AU
Database identifiers
- CAS
5687-22-9- PubChem CID
- 79769
- DTXSID
DTXSID60205397- ChEMBL
CHEMBL4297016- UNII
- E88VR4W4AU
- Nikkaji
- J15.128I
Properties
Computed structural properties
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 276
Physicochemical properties
- FDA UNII
- 88 VR4W4AU · E88VR4W4AU
- Toxicity
- 100 mg/kg · LDLo orl-rat: 100 mg/kg NCNSA6 5,13,1953
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LDLo orl-rat: 100 mg/kg NCNSA6 5,13,1953
Chemistry & industry
Applications
UsesAgricultural chemical.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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