Basic information
- CAS
405-30-1- Standard SMILES
Fc1ccc(SCc2ccc(Cl)cc2)cc1- InChIKey
GBZXOIUBLKUSJR-UHFFFAOYSA-N- Molecular formula
- C13H10ClFS
- Average molar mass
- 252.73 g/mol
- Monoisotopic mass
- 252.0175773
Names & identifiers
- Preferred name
- Fluorbenside
- IUPAC
- 1-chloro-4-[(4-fluorophenyl)sulfanylmethyl]benzene
- English name
- 1-chloro-4-[(4-fluorophenyl)sulfanylmethyl]benzene
- Molecular formula
- C13H10ClFS
- Molecular weight
- 252.73
Names & synonyms
FLUORBENSIDE405-30-1FluoroparacideFluorparacideFluorosulphacideFluorsulphacideFluorosulfacideFluorbenside [ISO]Caswell No. 183Bp-Chlorobenzyl p-fluorophenyl sulfidep-Chlorobenzyl p-fluorophenyl sulphideSulfide, p-chlorobenzyl p-fluorophenyl
Show more names
RD-2454HRS-942(4-Chlorobenzyl)(4-fluorophenyl)sulfane1-chloro-4-[(4-fluorophenyl)sulfanylmethyl]benzeneBenzene, 1-chloro-4-[[(4-fluorophenyl)thio]methyl]-
4-Chlorobenzyl 4'-fluorophenyl sulphideHSDB 1539HRS 9424-Chlorobenzyl 4-fluorphenyl sulphideEPA Pesticide Chemical Code 2833004-Chlorobenzyl 4'-fluorophenyl sulfideRD 2454BRN 3291675
Database identifiers
- CAS
405-30-1- PubChem CID
- 9836
- DTXSID
DTXSID6041979- UNII
- Q449322QX1
- Nikkaji
- J5.722C
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 196
Experimental & physicochemical properties
PesticidesPesticides -> Organochlorine Pesticides
Color/FormCRYSTALS
SolubilityINSOL IN WATER; SOL IN ACETONE & OILS
Melting Point36 °C
Vapor Pressure0.0000828 [mmHg]
Physical DescriptionSolid; [Hawley]
Physicochemical properties
- FDA UNII
- 449322 QX1 · Q449322QX1
- EPA Substance Registry System
- Fluorbenside (405-30-1)
- Hazardous Substances Data
- 405 · 405-30-1(Hazardous Substances Data)
- Toxicity
- 50 oral · LD50 oral in rat: 3gm/kg
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Hazards SummaryAcute toxicity in mammals slightly higher than that for chlorbenside; Rats fed 50 mg/kg for 3 weeks had slight enlargement of liver and kidneys; Lethal dose in humans probably 1 ounce to 1 pint; [HSDB] See Chlorbenside.
Toxicology
Adverse EffectsOther Poison - Organochlorine
Non-Human Toxicity ExcerptsACARICIDE WITH ACUTE MAMMALIAN TOXICITY SLIGHTLY HIGHER THAN CHLORBENSIDE. RATS ON A DAILY DOSE OF 50 MG/KG FOR 3 WK SHOWED SLIGHT ENLARGEMENT OF LIVER AND KIDNEYS.
Safety data
- Toxicity
- LD50 oral in rat: 3gm/kg
- Hazardous Substances Data
- 405-30-1(Hazardous Substances Data)
Chemistry & industry
Uses & manufacturing
Uses
Used as acaricide; No longer available in the US; [HSDB]
Farming (Pesticides) [Category: Industry]
ACARICIDE
General Manufacturing InformationNO LONGER AVAILABLE IN USA.
Applications
Uses(4-Chlorobenzyl)(4-fluorophenyl)sulfane is an acaricide.
Suppliers2 total
Alfa Chemistry+1-5166625404 · [email protected]
上海杰股生物科技有限公司021-51698675 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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