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O,S-Diethyl O-(4-nitrophenyl) phosphorothioate

HCID 11705
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Basic information

CAS
597-88-6
Standard SMILES
CCOP(=O)(Oc1ccc([N+](=O)[O-])cc1)SCC
InChIKey
BGWJTLLALYACOG-UHFFFAOYSA-N
Molecular formula
C10H14NO5PS
Average molar mass
291.265 g/mol
Monoisotopic mass
291.03303018

Names & identifiers

Preferred name
O,S-Diethyl O-(4-nitrophenyl) phosphorothioate
IUPAC
O,S-Diethyl O-(4-nitrophenyl) phosphorothioate
English name
Isoparathion
Molecular formula
C10H14NO5PS
Molecular weight
291.26

Names & synonyms

IsoparathionS-Ethyl parathionO,S-Diethyl O-(4-nitrophenyl) =phosphorothioatePhosphorothioic acid, O,S-diethyl O-(4-nitrophenyl) ester

Database identifiers

CAS
597-88-6
PubChem CID
11705
DTXSID
DTXSID00975103
Nikkaji
J53.829I

Properties

Physicochemical properties

Boiling point
375 °C · 375°C (estimate)
Density
1.2945 g/cm3 · 1.2945 g/cm3
Henry's Law Constant
6.1 · 6.1×101 mol/(m3Pa) at 25℃, Ebert et al. (2023)

Related reactions

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