Chemical Properties of Zytron

InChI

InChI=1S/C10H14Cl2NO2PS/c1-7(2)13-16(17,14-3)15-10-5-4-8(11)6-9(10)12/h4-7H,1-3H3,(H,13,17)

InChI Key

PJFGPJQBWSEWKX-UHFFFAOYSA-N

Formula

C10H14Cl2NO2PS

SMILES

COP(=S)(NC(C)C)Oc1ccc(Cl)cc1Cl

Molecular Weight¹

314.17

Other Names

• (1-Methylethyl)phosphoramidothioic acid O-(2,4-dichlorophenyl) O-methyl ester
• DMPA
• DMPA (Herbicide)
• Dow 1329
• Dowco 118
• ENT 25647
• Isopropylphosphoramidothioic acid, O-2,4-dichlorophenyl O-methyl ester
• K 22023
• O-(2,4-Dichlorophenyl) O-Methyl isopropylphosphoramidothioate
• O-(2,4-Dichlorophenyl) O-methyl N-isopropylphosphoramidothioate
• O-(2,4-dichlorophenyl) O-methyl-(1-methylethyl) phosphoramidothioate
• O-Methyl-O-(2,4-dichlorfenyl)ester kyseliny isopropylamidothiofosforecne
• OMS 115
• Phenol, 2,4-dichloro-, O-ester with O-methyl isopropylphosphoramidothioate
• Phosphoramidothioic acid, (1-methylethyl)-, O-(2,4-dichlorophenyl) O-methyl ester
• Phosphoramidothioic acid, isopropyl-, O-(2,4-dichlorophenyl) O-methyl ester

• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• 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_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
IE	8.14	eV	Relay (1.0) Calculated Property
log10WS	-4.86		Relay (1.0) Calculated Property
logPoct/wat	4.241		Crippen Calculated Property
McVol	211.010	ml/mol	McGowan Calculated Property
Inp	[1942.00; 1969.00]
Inp	1942.00		NIST
Inp	1969.00		NIST
Tboil	592.43	K	Relay (1.0) Calculated Property
Tfus	[322.39; 325.00]	K
Tfus	324.55	K	Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Tfus	322.39 ± 0.20	K	NIST
Tfus	325.00 ± 0.20	K	NIST

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to Zytron.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
Compiled This icon marks a compiled value or equation: taken from a data compilation such as ChemSep, not from an original measurement report.
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