Basic information
- CAS
80-38-6- Standard SMILES
O=S(=O)(Oc1ccc(Cl)cc1)c1ccccc1- InChIKey
SPJOZZSIXXJYBT-UHFFFAOYSA-N- Molecular formula
- C12H9ClO3S
- Average molar mass
- 268.72 g/mol
- Monoisotopic mass
- 267.99609283
Overview
Fenson is an arenesulfonic acid.
Names & identifiers
- Preferred name
- Fenson
- IUPAC
- (4-chlorophenyl) benzenesulfonate
- English name
- FENSON
- Molecular formula
- C12H9ClO3S
- Molecular weight
- 268.72
Names & synonyms
Show more names
Database identifiers
- CAS
80-38-6- PubChem CID
- 6636
- DTXSID
DTXSID6041973- ChEMBL
CHEMBL1495617- ChEBI
CHEBI:82160- UNII
- DFC2HB4I0K
- EC Number
- 201-274-6
- Nikkaji
- J4.249H
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 322
Experimental & physicochemical properties
Pesticides
Acaricides
Active substance -> EU Pesticides database: Not approved
Pesticides -> Organochlorine Pesticides
Other Experimental Properties
UNDERGOES HYDROLYSIS WITH ALKALI TO PHENOL & ALKALI SULFONATE
OFF-WHITE OR PINKISH /COMMERCIAL GRADE/
Physicochemical properties
- Melting point
- 62 ℃ · 62℃
- Boiling point
- 407 · 407.0±37.0 °C(Predicted)
- Density
- 1.33 g/cm3 · 1.33 g/cm3
- Flash point
- 100 °C · >100 °C
- storage temp.
- 0 · 0-6°C
- BRN
- 2696927 · 2696927
- Major Application
- agricultureenvironmental
- InChI
- 1S/C12H9ClO3S/c13-10-6-8-11(9-7-10)16-17(14,15)12-4-2-1-3-5-12/h1-9H
- InChIKey
- SPJOZZSIXXJYBT-UHFFFAOYSA-N
- SMILES
- Clc1ccc(OS(=O)(=O)c2ccccc2)cc1
- EWG's Food Scores
- 1 · 1-2
- FDA UNII
- 2 HB4I0K · DFC2HB4I0K
- EPA Substance Registry System
- Fenson (80-38-6)
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319-H411
- Precautionary statements
- 273 · P273-P301+P312+P330-P305+P351+P338
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xn,N
- Risk Statements
- 22 · 22-36-51/53
- Safety Statements
- 24 · 24-26-61
- RIDADR
- 3077 · UN3077 9/PG 3
- WGK Germany
- 2 · 2
- RTECS
- 5600000 · DB5600000
- HS Code
- 29089990 · 29089990
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 OralAquatic · Acute Tox. 4 OralAquatic Chronic 2Eye Irrit. 2
- Hazardous Substances Data
- 80 · 80-38-6(Hazardous Substances Data)
- Toxicity
- 50 oral · LD50 oral in rat: 1350mg/kg
Safety & regulation
GHS classification
GHS Classification
Warning
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P391, and P501 (click each P-code to see the statement)
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P391, and P501 (click each P-code to see the statement)
Hazard information
Hazards Summary
Continuous oral dosing of more than 1500 ppm is required for histopathological changes to be observed in rats; High doses over extended time cause fatty infiltration and enlargement of liver; [HSDB] An eye irritant; [eChemPortal: ESIS]; Caused moderate eye and minor skin irritation in rabbits; [RTECS]
Hazard Classes and Categories
Acute Tox. 4 (100%)
Acute toxicity - category 4
Acute toxicity (Oral) - Category 4
Acute Tox. 4 *
Toxicology
Ecotoxicity Values
LC50 RAINBOW TROUT 6.6 MG/L/96 HR AT 13 °C (95% CONFIDENCE LIMIT 5.5-8.0) WT 0.7 G
LC50 BLUEGILL 5.1 MG/L/96 HR AT 24 °C (95% CONFIDENCE LIMIT 3.6-7.3) WT 0.5 G
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 2
- rtecs
- DB5600000
- ridadr
- UN3077 9/PG 3
- hs_code
- 29089990
- Toxicity
- LD50 oral in rat: 1350mg/kg
- risk_code
- 22-36-51/53
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- hazard_code
- Xn,N
- safety_code
- 24-26-61
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H319-H411
- Hazard Classifications
- Acute Tox. 4 OralAquatic Chronic 2Eye Irrit. 2
- Precautionary statements
- P273-P301+P312+P330-P305+P351+P338
- Hazardous Substances Data
- 80-38-6(Hazardous Substances Data)
Chemistry & industry
Uses & manufacturing
Uses
Used as acaricide for orchard crops; [HSDB]
Farming (Pesticides) [Category: Industry]
ACARICIDE
Formulations/Preparations
WETTABLE POWDER 50% & 80%; EMULSIFIABLE 30%.
AEROSOL, FOR GREENHOUSE USE; 20% WETTABLE POWDER & MISCIBLE PREPN FOR ORCHARD USE AT RATES EQUIVALENT TO 0.025 TO 0.05% CPBS.
General Manufacturing Information
... CURRENTLY OF LITTLE COMMERCIAL INTEREST.
INCOMPATIBILITIES: ... COMPATIBLE WITH COMMONLY-USED SPRAY MATERIALS.
... SUSPECTED OF FRUIT DAMAGE TO APPLE. ... FOR GREENHOUSE USE DO NOT APPLY TO CUCURBITS OR TO TOMATOES IN YOUNG STAGE OF GROWTH.
RESISTANCE OF PANONYCHUS ULMI ... TO FENSON ... APPEARED IN ENGLAND IN 1957 & 1958.
For more General Manufacturing Information (Complete) data for 4-CHLOROPHENYL BENZENESULFONATE (6 total), please visit the HSDB record page.
Applications
UsesAcaricide.
Suppliers30 total
Additional notes
DefinitionChEBI: Fenson is an arenesulfonic acid.
Related reactions
Compound notes
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