Azamethiphos

C₉H₁₀ClN₂O₅PSCAS 35575-96-3324.67 g/mol

Open in Covalent MOL file

Aryl halide

Properties

Molecular formula: C₉H₁₀ClN₂O₅PS
Molar mass: 324.67 g/mol
Exact mass: 323.9737 Da
Melting point: 89 °C
logP: 2.73Crippen estimate
Polar surface area: 83.6 Å²
H-bond donors / acceptors: 0 / 7
Rotatable bonds: 5

Hazards

Danger

H302 Harmful if swallowedAcute toxicity, oral
H317 May cause an allergic skin reactionSensitization, Skin
H331 Toxic if inhaledAcute toxicity, inhalation
H351 Suspected of causing cancerCarcinogenicity
H370 Causes damage to organsSpecific target organ toxicity, single exposure
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, index 613-338-00-4), via PubChem.

Precautionary statements

P203, P260, P261, P264, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P308+P316, P316, P318, P321, P330, P333+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

35575-96-3

SMILES

COP(=O)(OC)SCn1c(=O)oc2cc(Cl)cnc21

InChIKey

VNKBTWQZTQIWDV-UHFFFAOYSA-N

InChI

InChI=1S/C9H10ClN2O5PS/c1-15-18(14,16-2)19-5-12-8-7(17-9(12)13)3-6(10)4-11-8/h3-4H,5H2,1-2H3

Weigh it out

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

Names and synonyms

7 names

Phosphorothioic acid, S-[(6-chloro-2-oxooxazolo[4,5-b]pyridin-3(2H)-yl)methyl] O,O-dimethyl ester
Oxazolo[4,5-b]pyridine, phosphorothioic acid deriv.
Ciba-geigy 18809
CGA 18809
Snip
Azametiphos
Salmosan

Work with Azamethiphos

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

Phosalone2310-17-042 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia