Basic information
- CAS
97-16-5- Standard SMILES
O=S(=O)(Oc1ccc(Cl)cc1Cl)c1ccccc1- InChIKey
OZFAFGSSMRRTDW-UHFFFAOYSA-N- Molecular formula
- C12H8Cl2O3S
- Average molar mass
- 303.2 g/mol
- Monoisotopic mass
- 301.95712048
Overview
structure
Names & identifiers
- Preferred name
- Genite
- IUPAC
- (2,4-dichlorophenyl) benzenesulfonate
- English name
- GENITE
- Molecular formula
- C12H8Cl2O3S
- Molecular weight
- 303.16
Names & synonyms
Show more names
Database identifiers
- CAS
97-16-5- PubChem CID
- 7327
- DTXSID
DTXSID5020447- ChEMBL
CHEMBL3184811- UNII
- 2VO951CU06
- EC Number
- 202-562-4
- Nikkaji
- J4.944A
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 360
Experimental & physicochemical properties
Vapor Pressure
0.0000004 [mmHg]
2.7X10-4 MM HG @ 30 °C
Physicochemical properties
- Melting point
- 45.5 ℃ · 45.5℃
- Boiling point
- 435.2 · 435.2±45.0 °C(Predicted)
- Density
- 1.4572 · 1.4572 (estimate)
- BRN
- 2944672 · 2944672
- CAS DataBase Reference
- 97 · 97-16-5(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 2 VO951CU06 · 2VO951CU06
- EPA Substance Registry System
- 2 · 2,4-Dichlorophenol benzenesulfonate (97-16-5)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 301 · P301+P312+P330
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
- WGK Germany
- 3 · 3
- RTECS
- 9100000 · SK9100000
- HS Code
- 29081990 · 29081990
- Hazardous Substances Data
- 97 · 97-16-5(Hazardous Substances Data)
- Toxicity
- 50 oral · LD50 oral in rabbit: 700mg/kg
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P262, P264, P270, P280, P301+P317, P302+P352, P316, P321, P330, P361+P364, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Toxicology
Non-Human Toxicity Excerpts
GENITE WAS NOT TUMORIGENIC WHEN ADMIN ORALLY TO MICE @ CONCN OF 297-1,000 MG/KG/DAY. /FROM TABLE/
IN ACUTELY POISONED ANIMALS VOMITING, UNSTEADINESS, GENERALIZED WEAKNESS & FINE TREMORS PRECEDED DEATH WHICH OCCURRED IN FROM 1 TO 4 DAYS. RABBITS & DOGS SHOWED MARKEDLY DILATED HEARTS & HEMORRHAGIC AREAS THROUGHOUT GI TRACT.
THERE WAS NO SIGN OF INTOXICATION TO RATS FED NINETY DAYS WITH DIET CONTAINING 3,000 PPM OF TECHNICAL PRODUCT.
Safety data
- wgk
- 3
- rtecs
- SK9100000
- hs_code
- 29081990
- Toxicity
- LD50 oral in rabbit: 700mg/kg
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Hazard statements
- H302
- Precautionary statements
- P301+P312+P330
- Hazardous Substances Data
- 97-16-5(Hazardous Substances Data)
Chemistry & industry
Pharmacology
Uses & manufacturing
Uses
Used as miticide for specialized control of European red mite and clover mite; [HSDB]
Farming (Pesticides) [Category: Industry]
MITICIDE SPECIFIC FOR EUROPEAN RED MITE & CLOVER MITE.
Methods of Manufacturing
GILBERT, US PATENT 2,618,583 (1952 TO ALLIED CHEMICAL).
MADE BY INTERACTION OF BENZENESULFONYL CHLORIDE WITH 2,4-DICHLOROPHENOL
Formulations/Preparations
TECHNICAL PRODUCT, @ LEAST 97% PURE
/GENITE 923 IS/ TRADEMARK FOR 2,4-DICHLOROPHENYL ESTER BENZENESULFONIC ACID; AVAILABLE AS 50% EMULSIFIABLE OR 50% WETTABLE POWDER.
General Manufacturing Information
Product discontinued by Allied Chemical Company
IT IS COMPATIBLE WITH MOST PESTICIDES. IT WAS INTRODUCED, IN 1947, AS ACARICIDE BY ALLIED CHEM CORP UNDER CODE NUMBER EM 923, TRADE MARKS GENITE & GENITOL... IT IS NON-SYSTEMIC ACARICIDE OF LOW INSECTICIDAL ACTIVITY & IS USED AGAINST PHYTOPHAGOUS MITES, GENERALLY @ 1.5 PINTS 50% EC/100 US GAL.
SAFE FOR USE @ PRE-BLOSSOM STAGES BUT MAY CAUSE LEAD YELLOWING & DAMAGE TO APPLES WHEN APPLIED LATER...
Applications
UsesAcaricide.
Uses2,4-Dichlorophenyl benzenesulphonate is a pesticide.
Suppliers23 total
Related reactions
Compound notes
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