Customization: | Available |
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Appearance: | Oil Based |
Source: | Organic Synthesis |
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Isomerism | Isomeric |
Chemical formula | C12H15N2O3PS |
Canonical SMILES | CCOP(=S)(OCC)ON=C(C#N)C1=CC=CC=C1 |
Isomeric SMILES | CCOP(=S)(OCC)O/N=C(\C#N)/C1=CC=CC=C1 |
International Chemical Identifier key (InChIKey) | ATROHALUCMTWTB-WYMLVPIESA-N |
International Chemical Identifier (InChI) | 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,3-4H2,1-2H3/b14-12+ |
Pesticide type | Insecticide, Other substance , Veterinary substance | |||
Other constituent type | Disinfectant | |||
Substance group | Organophosphate | |||
Minimum active substance purity | - | |||
Known relevant impurities | - | |||
Substance origin | Synthetic | |||
Mode of action | Non-systemic with contact and stomach action. Short activity period. Acetylcholinesterase (AChE) inhibitor. | |||
CAS RN | 14816-18-3 | |||
EC number | 238-887-3 | |||
CIPAC number | 364 | |||
US EPA chemical code | 598800 | |||
PubChem CID | 9570290 | |||
Molecular mass (g mol-1) | 298.3 | |||
PIN (Preferred Identification Name) | - | |||
IUPAC name | O,O-diethyl α-cyanobenzylideneaminooxyphosphonothioate | |||
CAS name | 4-ethoxy-7-phenyl-3,5-dioxa-6-aza-4-phosphaoct-6-ene-8-nitrile 4-sulphide | |||
Other status information | OSPAR soc |
Isomerism | A chiral molecule existing in the S- and R-forms. The commercial product is mixture of stereoisomers, the (S)-isomer primarily responsible for the bioactivity. |
Chemical formula | C22H23NO3 |
Canonical SMILES | CC1(C(C1(C)C)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C |
Isomeric SMILES | No data |
International Chemical Identifier key (InChIKey) | XQUXKZZNEFRCAW-UHFFFAOYSA-N |
International Chemical Identifier (InChI) | InChI=1S/C22H23NO3/c1-21(2)19(22(21,3)4)20(24)26-18(14-23)15-9-8-12-17(13-15)25-16-10-6-5-7-11-16/h5-13,18-19H,1-4H3 |
Pesticide type | Insecticide, Acaricide |
Substance group | Pyrethroid |
Minimum active substance purity | >90% |
Known relevant impurities | - |
Substance origin | Synthetic |
Mode of action | Non-systemic with contact and stomach action. Sodium channel modulator. |
CAS RN | 39515-41-8 |
Alternative/old CAS RN | 64257-84-7 |
EC number | 254-485-0 |
CIPAC number | 426 |
US EPA chemical code | 127901 |
PubChem CID | 47326 |
Molecular mass (g mol-1) | 349.42 |
PIN (Preferred Identification Name) | rac-(R)-cyano(3-phenoxyphenyl)methyl 2,2,3,3-tetramethylcyclopropane-1-carboxylate |
IUPAC name | (RS)-α-cyano-3-phenoxybenzyl 2,2,3,3-tetramethylcyclopropanecarboxylate |
CAS name | cyano(3-phenoxyphenyl)methyl 2,2,3,3-tetramethylcyclopropanecarboxylate |
Other status information | OSPAR soc; Severe Marine Pollutant; Chemical subject to PIC regulations |