ChemicalBook--->CAS DataBase List--->98886-44-3

98886-44-3

98886-44-3 Structure

98886-44-3 Structure
IdentificationMore
[Name]

Fosthiazate
[CAS]

98886-44-3
[Synonyms]

FOSTHIAZATE
NEMATHORIN
O-ETHYL S-(1-METHYLPROPYL) 2-OXO-3-THIAZOLIDINYLPHOSPHONOTHIOATE
S-SEC-BUTYL O-ETHYL 2-OXO-3-THIAZOLIDINYLPHOSPHONOTHIOATE
(2-oxo-3-thiazolidinyl)-phosphonothioicacio-ethyls-(1-methylpropyl)este
asc-66824
iki1145
s-sec-butylo-ethyl(2-oxo-1,3-thiazolidine-3-yl)phosphonothioate
(RS)-S-sec-butyl-O-ethyl-2-oxo-1,3--thiazolodin-3-ylphosphonothioate
O-ethyl-S-(1-methyl-propyl)(2-oxo-3-thiazolodinyl)phosphonothioate
FOSTHISZATE
fosthiazate (bsi,draft e-iso)
O-Ethyl S-(1-methylpropyl) 2-oxo-3-hiazolidinylphosphonothioate
fosthiazate (ISO) (RS)-S-sec-butyl-O-ethyl-2-oxo-1,3-thiazolidin-3-ylphosphonothioate
O-Ethyl S-(1-methylpropyl) 2-oxo-3-hiazolidinylphosphonothioate, S-sec-Butyl O-ethyl 2-oxo-3-thiazolidinylphosphonothioate
O-ethyl-S-sec-buty1-2-oxo-1, 3-thiazolidin-3-y1 phosphonothioate
(2-Oxothiazolidin-3-yl)thiophosphonic acid S-sec-butyl O-ethyl ester
[EINECS(EC#)]

-0
[Molecular Formula]

C9H18NO3PS2
[MDL Number]

MFCD00274595
[Molecular Weight]

283.35
[MOL File]

98886-44-3.mol
Chemical PropertiesBack Directory
[Melting point ]

<25 °C
[Boiling point ]

bp0.5 198°
[density ]

1.26±0.1 g/cm3(Predicted)
[refractive index ]

n19.6D 1.5334
[storage temp. ]

0-6°C
[solubility ]

Chloroform (Slightly), Water (Slightly)
[form ]

neat
[pka]

-2?+-.0.20(Predicted)
[color ]

White to off-white
[Henry's Law Constant]

7.5×101 mol/(m3Pa) at 25℃, MacBean (2012)
[Stability:]

Hygroscopic
[Major Application]

agriculture
environmental
[InChI]

InChI=1S/C9H18NO3PS2/c1-4-8(3)16-14(12,13-5-2)10-6-7-15-9(10)11/h8H,4-7H2,1-3H3
[InChIKey]

DUFVKSUJRWYZQP-UHFFFAOYSA-N
[SMILES]

P(N1CCSC1=O)(SC(C)CC)(=O)OCC
[CAS DataBase Reference]

98886-44-3(CAS DataBase Reference)
[EPA Substance Registry System]

98886-44-3(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

T,N
[Risk Statements ]

R21:Harmful in contact with skin.
R23/25:Toxic by inhalation and if swallowed .
R39:Danger of very serious irreversible effects.
R41:Risk of serious damage to eyes.
R43:May cause sensitization by skin contact.
R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S53:Avoid exposure-obtain special instruction before use .
S25:Avoid contact with eyes .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S39:Wear eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S60:This material and/or its container must be disposed of as hazardous waste .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN 2810
[WGK Germany ]

3
[RTECS ]

TB1707000
[HazardClass ]

6.1(b)
[PackingGroup ]

III
[HS Code ]

29341000
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Acute Tox. 3 Oral
Aquatic Acute 1
Aquatic Chronic 1
Eye Dam. 1
Skin Sens. 1
[Hazardous Substances Data]

98886-44-3(Hazardous Substances Data)
[Toxicity]

LD50 in male, female mice, male, female rats (mg/kg): 104, 91, 73, 57 orally; in male, female rats (mg/kg): 2396, 861 dermally. LC50 in male, female rats (mg/l): 0.832, 0.558 by inhalation (Toki).
Raw materials And Preparation ProductsBack Directory
[Raw materials]

n-Butyllithium-->Hexane-->Thiophosphoryl chloride-->Thiazolidine-->PYROGALLOL RED-->Cysteamine-->Oxazole-->colophonate
Hazard InformationBack Directory
[Description]

Fosthiazate is an organothiophosphate insecticide used to control nematodes and sucking / chewing insects. It is highly soluble in water, is not volatile and is not usually persistent in soil systems but may be in some water systems. It has a high mammalian oral toxicity but may be a neurotoxin. It is highly toxic to most terrestrial biodiversity but moderately toxic to most aquatic species.
[Uses]

Nematicide.
[Uses]

thiazolidin e thione pharmaceutical intermediate
[Definition]

ChEBI: Fosthiazate is a phosphonic ester, an organic phosphonate and an organothiophosphate insecticide. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, an agrochemical and a nematicide.
[Production Methods]

Commercial production of fosthiazate typically begins with the synthesis of its organophosphorus backbone, involving the reaction of phosphorothioate derivatives with alcohols and heterocyclic intermediates. A key step includes forming the thiazolidinone ring, which is then coupled with the phosphorus-containing moiety to yield the active nematicidal compound. The process requires precise control over reaction conditions to ensure the correct stereochemistry.
[Agricultural Uses]

Insecticide, Nematicide: Systemic pesticide applied to the soil.
[Trade name]

CGA 41065®; IKI 1145®; NEMATHORIN®; PREMEIR®; PRIME®
[Mechanism of action]

Systemic. Acetylcholinesterase (AchE) inhibitor.
[Pesticide Type]

Insecticide; Nematicide
Spectrum DetailBack Directory
[Spectrum Detail]

Fosthiazate(98886-44-3)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

98886-44-3(sigmaaldrich)
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