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Azidithion

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Name

Azidithion

EINECS N/A
CAS No. 78-57-9 Density 1.548g/cm3
PSA 161.35000 LogP 1.83250
Solubility 0.24g/L(20 oC) Melting Point 160-162(部分分解)oC
Formula C6H12 N5 O2 P S2 Boiling Point 503.2oC at 760 mmHg
Molecular Weight 281.299 Flash Point 258.1°C
Transport Information N/A Appearance N/A
Safety Moderately toxic by ingestion and possibly other routes. Mutation data reported. When heated to decomposition it emits very toxic fumes of NOx, POx, and SOx. Risk Codes R22; R52/53
Molecular Structure Molecular Structure of 78-57-9 (AZIDITHION) Hazard Symbols Highly toxic, cholinesterase inhibitor.
Synonyms

Phosphorodithioicacid, S-[(4,6-diamino-s-triazin-2-yl)methyl] O,O-dimethyl ester (8CI);2,4-Diamino-6-dimethoxyphosphinothionylthiomethyl-s-triazine; Azidithion;Menazon; O,O-Dimethyl S-(4,6-diamino-1,3,5-triazin-2-yl)methylphosphorothiolothionate; O,O-DimethylS-(4,6-diamino-s-triazin-2-ylmethyl)phosphorodithioate; PP.175; R 15,175;S-(4,6-Diamino-1,3,5-triazin-2-ylmethyl) O,O-dimethyl phosphorodithioate;S-(4,6-Diamino-1,3,5-triazin-2-ylmethyl) dimethyl phosphorothiolothionate;S-[(4,6-Diamino-s-triazin-2-yl)methyl]-O,O-dimethyl phosphorodithioate;S-[(4,6-Diamino-s-triazine-2-yl)methyl] O,O-dimethyl phosphorodithioate;Sayfos; Sayphos

Article Data 3

Azidithion Chemical Properties

Chemistry informtion about Azidithion(CAS NO.78-57-9) is:
IUPAC Name:  6-(dimethoxyphosphinothioylsulfanylmethyl)-1,3,5-triazine-2,4-diamine
Synonyms: Azidithion ; Menazon ; 2,4-Diamino-6-Dimethoxyphosphinothionylthiomethyl-S-Triazine ; 2-Dimethoxyphosphinothioylthiomethyl-4,6-Diamino-S-Triazine ; 4,6-Diamino-1,3,5-Triazin-2-Ylmethylo,O-Dimethylphosphorodithioate ; Dithiophosphatedeo,O-Dimethyleetdes-((4,6-Diamino-1,3,5-Triazine-2-Yl)-M ; Dithiophosphatedeo,O-Dimethyleetdes-(4,6-Diamino-1,3,5-Triazine-2-Yl)-Meth ; Ent25,760
MF: C6H12N5O3PS
MW: 265.23
EINECS: 201-123-4 
Density: 1.548 g/cm3
Flash Point: 258.1 °C
Enthalpy of Vaporization: 77.24 kJ/mol
Boiling Point: 503.2 °C at 760 mmHg
Vapour Pressure: 2.98E-10 mmHg at 25°C
Following is the molecular structure of Azidithion(CAS NO.78-57-9) is:

Azidithion Production

Raw materials: Sodium hydroxide-->Ethyl chloroacetate-->Pivaloyl chloride-->Dimethylcarbamoyl chloride -->N-Aminothiourea

Azidithion Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
chicken LD50 oral 487mg/kg (487mg/kg) behavioral: convulsions or effect on seizure threshold Toxicology and Applied Pharmacology. Vol. 7, Pg. 606, 1965.
mammal (species unspecified) LD50 unreported 900mg/kg (900mg/kg)   "Chemistry of Pesticides," Melnikov, N.N., New York, Springer-Verlag New York, Inc., 1971Vol. -, Pg. 373, 1971.
mouse LD50 oral 427mg/kg (427mg/kg)   Special Publication of the Entomological Society of America. Vol. 78-1, Pg. 48, 1978.
rabbit LD50 skin > 800mg/kg (800mg/kg)   Special Publication of the Entomological Society of America. Vol. 78-1, Pg. 48, 1978.
rat LD50 oral 890mg/kg (890mg/kg)   Agricultural Research Service, USDA Information Memorandum. Vol. 20, Pg. 14, 1966.
rat LD50 skin > 2gm/kg (2000mg/kg)   Toxicology and Applied Pharmacology. Vol. 14, Pg. 515, 1969.

Azidithion Consensus Reports

EPA Genetic Toxicology Program.

Azidithion Safety Profile

Moderately toxic by ingestion and possibly other routes. Mutation data reported. When heated to decomposition it emits very toxic fumes of NOx, POx, and SOx
Hazard Codes:
HarmfulXn
Risk Statements:
R22:Harmful if swallowed. 
R52/53:Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Safety Statements:
S61:Avoid release to the environment. Refer to special instructions / safety data sheets.

Azidithion Specification

Descriptors Computed from Structure about Azidithion(CAS NO.78-57-9) is:
Canonical SMILES: COP(=S)(OC)SCC1=NC(=NC(=N1)N)N
InChI: InChI=1S/C6H12N5O2PS2/c1-12-14(15,13-2)16-3-4-9-5(7)11-6(8)10-4/h3H2,1-2H3,(H4,7,8,9,10,11)
InChIKey: SUYHYHLFUHHVJQ-UHFFFAOYSA-N

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