Encyclopédie Chimique / Pharmaceutical Intermediates / Custom Manufacturing

DICHLOFENTHION

CAS：97-17-6
MW:315.153181
MF：C10H13Cl2O3PS

DICHLOFENTHION, with the chemical formula C10H14Cl2O2PS and CAS registry number 97-17-6, is a compound known for its use as an organophosphorus insecticide. This colorless to light yellow liquid is characterized by its dichloro and phosphorothioate functional groups. It is commonly used to control a wide range of pests in agriculture and horticulture, including aphids, mites, and whiteflies. DICHLOFENTHION acts by inhibiting the activity of acetylcholinesterase, an enzyme essential for the proper functioning of the nervous system in insects. However, it is important to note that DICHLOFENTHION has been classified as a hazardous substance and should be handled with care. It is recommended to follow proper safety precautions and guidelines when using this compound.

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nom et identifiant
Propriétés
Sécurité
MSDS
informations complémentaires
données chimiques calculées

1. nom et identifiant

1.1 Nom du produit: DICHLOFENTHION

1.2 synonymes: nemacidevc-13;o,o-diaéthyl-o-2,4-dichlor-phényl-monothiophosphat;O,O-Diaéthyl-O-2,4-dichlorphényl-thionophosphat;O,O-Diéthyl O-(2,4- dichlorophényl) thiophosphate ;O,O-diéthyl-O-(2,4-dichlor-fenyl)-monothiofosfaat ;o,o-diéthylo-2,4-dichlorophénylthiophosphate ;O,O-Dietil-O-(2,4-dichloro -fenil)-monotiofosfato ; 2,4-dichloro-, O-ester de phénol avec le phosphorothioate de O,O-diéthyle

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1.3 CAS No.: 97-17-6

1.4 CID: 7328

1.5 Numéro EINECS: 202-564-5

1.6 Formule moléculaire: C10H13Cl2O3PS

1.7 Inchi: InChI=1S/C10H13Cl2O3PS/c1-3-13-16(17,14-4-2)15-10-6-5-8(11)7-9(10)12/h5-7H,3-4H2,1-2H3

1.8 InchiKey: WGOWCPGHOCIHBW-UHFFFAOYSA-N

1.9 Canonique SMILES: CCOP(=S)(OCC)OC1=C(C=C(C=C1)Cl)Cl

1.10 Isomérique SMILES: CCOP(=S)(OCC)OC1=C(C=C(C=C1)Cl)Cl

2. Propriétés

2.1 Point d'ébullition: bp0.1 164-169 °

2.2 Solubilité: 245ug/L(25 ºC)

2.3 Stockage: 0-6 ° C

3. Sécurité

3.1 Codes de danger: Xn, N

3.2 Phrase R: 22-50 / 53

3.3 Phrase S: 60-61

3.4 RIDADR: 2783

3.5 RTECS: TF0350000

3.6 Sécurité et dangers

Codes de danger	Xn, N
Phrase R	22-50 / 53
Phrase S	60-61
RIDADR	2783
RTECS	TF0350000
Classe de stockage	6.1 (b)
Groupe d'emballage	III
Phytotoxicité	DL50 chez les rats mâles et femelles (mg/kg) : 185, 172 par voie orale ; 576, 355 par voie cutanée (Gaines, Linder)

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4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

Hazardous to the aquatic environment, short-term (Acute) - Category Acute 1

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word	Warning
Hazard statement(s)	H302 Harmful if swallowed H400 Very toxic to aquatic life H410 Very toxic to aquatic life with long lasting effects
Precautionary statement(s)
Prevention	P264 Wash ... thoroughly after handling. P270 Do not eat, drink or smoke when using this product. P273 Avoid release to the environment.
Response	P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/\u2026if you feel unwell. P330 Rinse mouth. P391 Collect spillage.
Storage	none
Disposal	P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

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5. Route synthétique

97-17-6Total: 3 Route synthétique

38176-72-6

97-17-6 27 Fournisseurs

2524-04-1

120-83-2 160 Fournisseurs

97-17-6 27 Fournisseurs

6. Précurseurs et produits

Précurseurs:

120-83-2

38176-72-6

3757-76-4

Produits:

3279-62-7

7. données chimiques calculées

Molecular Weight：315.153181g/mol
Molecular Formula：C₁₀H₁₃Cl₂O₃PS
Compound Is Canonicalized：True
XLogP3-AA：313.9700078
Monoisotopic Mass：313.9700078
Complexity：270
Rotatable Bond Count：6
Hydrogen Bond Donor Count：0
Hydrogen Bond Acceptor Count：4
Topological Polar Surface Area：59.8
Heavy Atom Count：：17
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：0
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADccBwMAJGAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGgIAACAACAagkCIyBoAAARCAACBCAAACAAAgJUAIiAAGC4gIJiKBExKAMAAkwBEIiAeAQAAAACAAAACACAAAQAAAAQAQAAAAAAAAAA==