Azinphos-methyl

C₁₀H₁₂N₃O₃PS₂CAS 86-50-0317.32 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₁₂N₃O₃PS₂
Molar mass: 317.32 g/mol
Exact mass: 317.0058 Da
Density: 1.44 g/mL (at 20 °C)
Melting point: 72–74 °C
Water solubility: 20.9 mg/L (20 °C)
logP: 2.00Crippen estimate
Polar surface area: 66.2 Å²
H-bond donors / acceptors: 0 / 7
Rotatable bonds: 5

Hazards

Danger

H300 Fatal if swallowedAcute toxicity, oral
H311 Toxic in contact with skinAcute toxicity, dermal
H317 May cause an allergic skin reactionSensitization, Skin
H330 Fatal if inhaledAcute toxicity, inhalation
H400 Very toxic to aquatic lifeHazardous to the aquatic environment, acute hazard
H410 Very toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI), via PubChem.

Precautionary statements

P260, P261, P262, P264, P270, P271, P272, P273, P280, P284, P301+P316, P302+P352, P304+P340, P316, P320, P321, P330, P333+P317, P361+P364, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

86-50-0

SMILES

COP(=S)(OC)SCn1nnc2ccccc2c1=O

InChIKey

CJJOSEISRRTUQB-UHFFFAOYSA-N

InChI

InChI=1S/C10H12N3O3PS2/c1-15-17(18,16-2)19-7-13-10(14)8-5-3-4-6-9(8)11-12-13/h3-6H,7H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

39 names · show all

Phosphorodithioic acid, O,O-dimethyl S-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl] ester
Phosphorodithioic acid, O,O-dimethyl ester, S-ester with 3-(mercaptomethyl)-1,2,3-benzotriazin-4(3H)-one
1,2,3-Benzotriazine, phosphorodithioic acid deriv.
Bayer 17147
ENT 23,233
S-(3,4-Dihydro-4-oxo-benzo[d][1,2,3]triazin-3-ylmethyl) O,O-dimethyl phosphorodithioate
S-(3,4-Dihydro-4-oxo-1,2,3-benzotriazin-3-ylmethyl) O,O-dimethyl phosphorodithioate
O,O-Dimethyl S-(4-oxo-3H-1,2,3-benzotriazine-3-methyl)phosphorodithioate
O,O-Dimethyl S-(4-oxobenzotriazino-3-methyl)phosphorodithioate
O,O-Dimethyl S-4-oxo-1,2,3-benzotriazin-3(4H)-ylmethyl phosphorodithioate
O,O-Dimethylphosphorodithioate S-ester with 3-(mercaptomethyl)-1,2,3-benzotriazin-4-(3H)-one
Guthion
3-(Mercaptomethyl)-1,2,3-benzotriazin-4(3H)-one O,O-dimethyl phosphorodithioate S-ester
Methyl guthion
Cotneon
Azinfos-methyl
Gusathion M
Gusathion 20
Cotnion
Azinphos
Gusathion
Gusathion 25
Methylgusathion
O,O-Dimethyl S-(3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl-methyl) dithiophosphate
S-(3,4-Dihydro-4-oxobenzo[d]-1,2,3-triazin-3-ylmethyl) dimethyl phosphorothiolothionate
O,O-Dimethyl S-[4-oxo-1,2,3-benzotriazine-3(4H)-ylmethyl] phosphorodithioate
Gusathion-methyl
Methyl-azinphos
Azinphos M
Carfene
Pancide
Toxation
Azinugec
Cotnion-methyl
Sepizin M
Metazintox
BAY 17147
Azimil
Methyltriazothion

Work with Azinphos-methyl

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Azinphos-ethyl2642-71-977 % similar Methidathion950-37-843 % similar DEPBT165534-43-042 % similar 3,4-Dihydro-3-hydroxy-4-oxo-1,2,3-benzotriazine28230-32-242 % similar Phosmet732-11-638 % similar Hdbtu164861-52-335 % similar N,N,N',N'-Tetramethyl-O-(3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl)uronium tetrafluoroborate125700-69-835 % similar Methyl trithion953-17-335 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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