Chemical Properties of Phosphorothioic acid, O-(1,6-dihydro-6-oxo-1-phenyl-3-pyridazinyl) O,O-diethyl ester (CAS 119-12-0)

InChI

InChI=1S/C14H17N2O4PS/c1-3-18-21(22,19-4-2)20-13-10-11-14(17)16(15-13)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3

InChI Key

CXJSOEPQXUCJSA-UHFFFAOYSA-N

Formula

C14H17N2O4PS

SMILES

CCOP(=S)(OCC)Oc1ccc(=O)n(-c2ccccc2)n1

Molecular Weight¹

340.33

CAS

119-12-0

Other Names

Pyridafenthion
Phosphorothioic acid, O,O-diethyl ester, O-ester with 6-hydroxy-2-phenyl-3(2H)pyridazinone
American cyanamid 12,503
CL 12503
O,O-Diethyl O-(2,3-dihydro-3-oxo-2-phenyl-6-pyridazinyl)phosphorothioate
O,O-Diethylphosphorothioate, O-ester with 6-hydroxy-2-phenyl-3(2H)-pyridazinone
O-(1,6-Dihydro-6-oxo-1-phenylpyridazin-3-yl) O,O-diethyl phosphorothioate
ENT 23,968
Ofnack
Ofnak
Ofunack
Pyridaphenthion
3(2H)-Pyridazinone, 6-hydroxy-2-phenyl-, O-ester with O,O-diethyl phosphorothioate
O,O-diethyl O-(1,6-dihydro-6-oxo-1-phenylpyridazin-3-yl) thiophosphate

log₁₀WS : Log10 of Water solubility in mol/l.
logP_oct/wat : Octanol/Water partition coefficient.
McVol : McGowan's characteristic volume (ml/mol).
I_np : Non-polar retention indices.
¹: Molecular weight from the IUPAC atomic weights tables.

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Physical Properties

Property	Value	Unit	Source
log₁₀WS	-0.12		Crippen Calculated Property
logP_oct/wat	2.909		Crippen Calculated Property
McVol	240.850	ml/mol	McGowan Calculated Property
I_np	[2418.00; 2478.00]
I_np	2418.00		NIST
I_np	2437.00		NIST
I_np	2478.00		NIST
I_np	2455.00		NIST
I_np	2437.00		NIST
I_np	2450.00		NIST

Similar Compounds

Find more compounds similar to Phosphorothioic acid, O-(1,6-dihydro-6-oxo-1-phenyl-3-pyridazinyl) O,O-diethyl ester.

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