Chemical Properties of Phosphorothioic acid, O,O-diethyl O-[2-(ethylthio)ethyl] ester (CAS 298-03-3)

InChI

InChI=1S/C8H19O3PS2/c1-4-9-12(13,10-5-2)11-7-8-14-6-3/h4-8H2,1-3H3

InChI Key

DGLIBALSRMUQDD-UHFFFAOYSA-N

Formula

C8H19O3PS2

SMILES

CCOP(=S)(OCC)OCCSCC

Molecular Weight¹

258.34

CAS

298-03-3

Other Names

Demetonthione
Demeton thiono
Demeton-O
O,O-Diethyl O-[2-(ethylthio)ethyl] phosphorothionate
O,O-Diethyl O-2-(ethylthio)ethyl phosphorothioate
Di-Septon
Diethyl (2-(eththio)ethyl) thionophosphate
Diethyl (2-(ethylthio)ethyl) phosphorothionate
Ethanol, 2-(ethylthio)-, O-ester with O,O-diethyl phosphorothioate
Thiolmecaptophos
Diaethylthiophosphorsaeureester des aethylthioglykol
Demethon-O
NSC 8928
Phosphorothioic acid, O,O-diethyl ester O-[2-(ethylthio)ethyl] ester
O,O-diethyl-O-[2-(ethylthio)ethyl] thiophosphate

Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
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
Δ_vapH°	78.70	kJ/mol	NIST
log₁₀WS	1.43		Crippen Calculated Property
logP_oct/wat	3.054		Crippen Calculated Property
McVol	194.350	ml/mol	McGowan Calculated Property
I_np	[1598.00; 1621.00]
I_np	1598.00		NIST
I_np	1621.00		NIST

Similar Compounds

Find more compounds similar to Phosphorothioic acid, O,O-diethyl O-[2-(ethylthio)ethyl] ester.

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