Quinalphos

C₁₂H₁₅N₂O₃PSCAS 13593-03-8298.30 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₅N₂O₃PS
Molar mass: 298.30 g/mol
Exact mass: 298.0541 Da
Melting point: 31.5 °C
Boiling point: 142 °C
logP: 3.31Crippen estimate
Polar surface area: 53.5 Å²
H-bond donors / acceptors: 0 / 6
Rotatable bonds: 6

Identifiers

CAS number

13593-03-8

SMILES

CCOP(=S)(OCC)Oc1cnc2ccccc2n1

InChIKey

JYQUHIFYBATCCY-UHFFFAOYSA-N

InChI

InChI=1S/C12H15N2O3PS/c1-3-15-18(19,16-4-2)17-12-9-13-10-7-5-6-8-11(10)14-12/h5-9H,3-4H2,1-2H3

Weigh it out

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

Names and synonyms

24 names · show all

Phosphorothioic acid, O,O-diethyl O-2-quinoxalinyl ester
Bayrusil
O,O-Diethyl O-(quinoxalin-2-yl) thiophosphate
O,O-Diethyl O-(2-quinoxalyl) phosphorothionate
O,O-Diethyl-O-quinoxal-2-yl thionophosphate
SAN 6538
Sandoz 6538
Diethyl 2-quinoxalyl phosphorothionate
Bayer 77049
BAY 77049
Diethchinalphion
SAN 6626
Sandoz 6626
Ekalux
Quinaltaf
O,O-Diethyl O-2-quinoxalinyl phosphorothioate
Ekalux G5
Diethquinalphion
Quinalfos
Oleoekalux
O,O-Diethyl-O-(2-quinoxalyl)thiophosphate
Kinalux
Ekalux 25EC
Chinalphos

Work with Quinalphos

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Thionazin297-97-255 % similar Pyridaphenthion119-12-045 % similar Triazofos24017-47-845 % similar Diazinon333-41-544 % similar Pirimiphos ethyl23505-41-143 % similar Sulfotep3689-24-542 % similar Dichlofenthion97-17-642 % similar Chlorpyrifos2921-88-241 % similar

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

Same formula

Phoxim14816-18-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia