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EPN

CAS: 2104-64-5
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2104-64-5

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1 EPN
2 Santox
3 O-Ethyl O-(4-nitrophenyl) phenylphosphonothioate
4 Kasutop Dust
5 Tsumaphos

EPN is an organic phosphonate, a phosphonic ester and an organothiophosphate insecticide. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, an acaricide and an agrochemical.

Molecular Formula C14H14NO4PS
Canonical SMILES CCOP(=S)(C1=CC=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-]
Isomeric SMILES CCOP(=S)(C1=CC=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-]
Molecular Weight 323.3100
InChIKey AIGRXSNSLVJMEA-UHFFFAOYSA-N
InChI InChI=1S/C14H14NO4PS/c1-2-18-20(21,14-6-4-3-5-7-14)19-13-10-8-12(9-11-13)15(16)17/h3-11H,2H2,1H3
XLogP 4.4000
ExactMass 323.0381
MonoisotopicMass 323.0381
TPSA 96.4000
Complexity 387.0000
Charge 0.0000
HBondDonorCount 0
HBondAcceptorCount 5
RotatableBondCount 5
HeavyAtomCount 21
IsotopeAtomCount 0
AtomStereoCount 1
DefinedAtomStereoCount 0
UndefinedAtomStereoCount 1
BondStereoCount 0
DefinedBondStereoCount 0
UndefinedBondStereoCount 0
CovalentUnitCount 1
PatentCount 14672
PatentFamilyCount 3968
LiteratureCount 257