Phoxim
Properties
- Molecular formula
- C12H15N2O3PS
- Molar mass
- 298.30 g/mol
- Exact mass
- 298.0541 Da
- Density
- 1.76 g/mL (at 20 °C)
- Melting point
- 6.1 °C
- Boiling point
- 102 °C
- logP
- 3.23Crippen estimate
- Polar surface area
- 63.8 Ų
- H-bond donors / acceptors
- 0 / 6
- Rotatable bonds
- 7
Hazards
Warning
- H302 Harmful if swallowedAcute toxicity, oral
- H317 May cause an allergic skin reactionSensitization, Skin
- H361f *** Suspected of damaging fertilityReproductive toxicity
- 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
P203, P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P318, P321, P330, P333+P317, P362+P364, P391, P405, P501
Identifiers
CAS number
14816-18-3SMILES
CCOP(=S)(OCC)ON=C(C#N)c1ccccc1InChIKey
ATROHALUCMTWTB-UHFFFAOYSA-NInChI
InChI=1S/C12H15N2O3PS/c1-3-15-18(19,16-4-2)17-14-12(10-13)11-8-6-5-7-9-11/h5-9H,3-4H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
25 names · show all
- Phosphorothioic acid, O-[(cyanophenylmethylene)azanyl] O,O-diethyl ester
- Glyoxylonitrile, phenyl-, oxime O,O-diethyl phosphorothioate
- 3,5-Dioxa-6-aza-4-phosphaoct-6-ene-8-nitrile, 4-ethoxy-7-phenyl-, 4-sulfide
- Phosphorothioic acid, O,O-diethyl ester, O-[(α-cyanobenzylidene)amino] deriv.
- BAY 77488
- Bayer 77488
- Phenylglyoxylonitrile oxime O,O-diethyl phosphorothioate
- B 77488
- Baythion
- Benzoyl cyanide O-(diethoxyphosphinothioyl)oxime
- Valexon
- Volaton
- BAY 5621
- Bayer 5621
- O,O-Diethyl O-(α-cyanobenzylideneamino) phosphorothioate
- Folaton
- Volaton bjdse 20
- Tomiguard PE 50
- Basileum SI
- Basileum SI 84EC
- Xylasan VL
- Basileum SI 84
- Sebacil
- Toyothion
- Jiubaojing
Reactions
Work with Phoxim
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
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile58632-95-441 % similar
Ethyl 2-cyano-3,3-diphenylacrylate5232-99-538 % similar
Sulfotep3689-24-536 % similar
Triazofos24017-47-835 % similar
Ethyl benzimidate hydrochloride5333-86-834 % similar
Pyridaphenthion119-12-033 % similar
Cyanofenphos13067-93-133 % similar
Ethyl benzoate93-89-033 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds