Chemical Properties of Quinalphos (CAS 13593-03-8)

InChI

InChI=1S/C12H15N2O3PS/c1-3-15-18(19,16-4-2)17-12-9-13-10-7-5-6-8-11(10)14-12/h5-9H,3-4H2,1-2H3

InChI Key

JYQUHIFYBATCCY-UHFFFAOYSA-N

Formula

C12H15N2O3PS

SMILES

CCOP(=S)(OCC)Oc1cnc2ccccc2n1

Molecular Weight¹

298.30

CAS

13593-03-8

Other Names

Phosphorothioic acid, O,O-diethyl O-2-quinoxalinyl ester
Bayer 77049
Bayrusil
BAY 77049
Diethchinalphion
Diethyl 2-Quinoxalyl phosphorothionate
Ekalux
O,O-Diethyl O-(quinoxalin-2-yl) thiophosphate
O,O-Diethyl O-(2-quinoxalyl) phosphorothionate
Quinolphos
Sandoz 6538
Sandoz 6626
SAN 6538
SAN 6626
Diethquinalphion
Diethyl O-(2-quinoxalyl) phosphorothioate
Diethyl O-(quinoxalin-2-yl) thiophosphate
Diethyl O-2-quinoxalinyl phosphorothioate
Diethyl O-quinoxalin-2-yl thionophosphate
O,O-Diethyl O-2-quinoxalinyl phosphorothioate
Savall
SRA 7312
Wie oben
Quinaltaf
O,O-diethyl O-quinoxalin-2-yl phosphothioate

Δ_fusH : Enthalpy of fusion at a given temperature (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.
T_fus : Normal melting (fusion) point (K).
¹: Molecular weight from the IUPAC atomic weights tables.

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Physical Properties

Property	Value	Unit	Source
log₁₀WS	-0.61		Crippen Calculated Property
logP_oct/wat	3.306		Crippen Calculated Property
McVol	211.100	ml/mol	McGowan Calculated Property
I_np	[2067.00; 2086.00]
I_np	2067.00		NIST
I_np	2075.00		NIST
I_np	2086.00		NIST
T_fus	304.48 ± 0.20	K	NIST

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Δ_fusH	25.40	kJ/mol	304.10	NIST

Similar Compounds

Find more compounds similar to Quinalphos.

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