Chemical Properties of Omethoate (CAS 1113-02-6)

InChI

InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)

InChI Key

PZXOQEXFMJCDPG-UHFFFAOYSA-N

Formula

C5H12NO4PS

SMILES

CN=C(O)CSP(=O)(OC)OC

Molecular Weight¹

213.19

CAS

1113-02-6

Other Names

Phosphorothioic acid, O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] ester
Phosphorothioic acid, O,O-dimethyl ester, S-ester with 2-mercapto-N-methylacetamide
Bayer 45432
BAY 45432
Dimethoate Oxygen analog
Dimethoate O-analog
Dimethoate PO isologue
Dimethoxon
Folimat
Folimat 4E
O,O-Dimethyl S-[(methylcarbamoyl)methyl] phosphorothioate
PO-Dimethoate
Acetamide, 2-mercapto-N-methyl-, S-ester with O,O-dimethyl phosphorothioate
BAYER 45,432
O,O-Dimethyl S-(2-(methylamino)-2-oxoethyl)phosphorothioate
O,O-Dimethyl-S-((N-methyl-carbamoyl)-methyl)-monothiofosfaat
O,O-Dimethyl-S-(N-methyl-carbamoyl)-methyl-monothiophosphate
O,O-Dimethyl-S-(N-methylcarbamoylmethyl)phosphorothioate
O,O-Dimethyl S-(N-methylcarbamoylmethyl) phosphorothiolate
Dimethyl-S-(N-methyl-carbamoyl-methyl)phosphorothiolate
O,O-Dimethyl-S-(N-methyl-carbamoyl-methyl)-thiolphosphate
O,O-Dimethyl S-(N-methylcarbamoylmethyl) thiophosphate
O,O-Dimethyl-S-(2-oxo-3-azabutyl)-monothiophosphate
O,O-Dimetil-S-(N-metil-carbamoil)-metil-monotiofosfato
ENT 25,776
O-Analog of dimethoate
Omethoat
P=O-Rogor
S6876
Thiophosphate de O,O-dimethyle et de S-(N-methylcarbamoyl) methyle
Dimethoate oxon
Dimethoate-met

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	-2.22		Crippen Calculated Property
logP_oct/wat	1.707		Crippen Calculated Property
McVol	147.280	ml/mol	McGowan Calculated Property
I_np	[1588.00; 1640.00]
I_np	1640.00		NIST
I_np	1640.00		NIST
I_np	1588.00		NIST
I_np	1603.00		NIST
I_np	1628.00		NIST
I_np	1630.00		NIST
I_np	1596.00		NIST
I_np	1596.00		NIST
I_np	1596.00		NIST
I_np	1630.00		NIST
I_np	1640.00		NIST

Similar Compounds

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