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Thiophosphoric acid trimorpholide

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Name

Thiophosphoric acid trimorpholide

EINECS N/A
CAS No. 14129-98-7 Density 1.32g/cm3
PSA 79.31000 LogP 0.67180
Solubility 3.21g/L(25 oC) Melting Point N/A
Formula C12H24 N3 O3 P S Boiling Point 455.7°Cat760mmHg
Molecular Weight 321.381 Flash Point 229.4°C
Transport Information N/A Appearance N/A
Safety Mutation data reported. When heated to decomposition it emits toxic vapors of NOx, SOx and POx. Risk Codes N/A
Molecular Structure Molecular Structure of 14129-98-7 (PHOSPHOROTHIOICTRIMORPHOLIDE) Hazard Symbols N/A
Synonyms

Phosphinesulfide, trimorpholino- (8CI); NSC 202920; Thiophosphoric acid trimorpholide

Article Data 4

Thiophosphoric acid trimorpholide Chemical Properties

Molecule structure of Thiophosphoric acid trimorpholide (CAS NO.14129-98-7) :

IUPAC Name of Thiophosphoric acid trimorpholide (CAS NO.14129-98-7) : trimorpholin-4-yl(sulfanylidene)-λ5-phosphane 
Molecular Weight: 321.376021 g/mol
Molecular Formula: C12H24N3O3PS 
Density: 1.32 g/cm3 
Boiling Point: 455.7 °C at 760 mmHg
Flash Point: 229.4 °C
Index of Refraction: 1.591
Molar Refractivity: 82.09 cm3
Molar Volume: 242.6 cm3
Polarizability: 32.54×10-24 cm3
Surface Tension: 59.9 dyne/cm
Enthalpy of Vaporization: 71.55 kJ/mol
Vapour Pressure: 1.73E-08 mmHg at 25 °C 
log P (octanol-water): -0.220
Water Solubility: 3220 mg/L 
Atmospheric OH Rate Constant: 2.77E-10 cm3/molecule-sec
XLogP3: 0.1
H-Bond Acceptor: 6
Rotatable Bond Count: 3
Exact Mass: 321.127599
MonoIsotopic Mass: 321.127599
Topological Polar Surface Area: 37.4
Heavy Atom Count: 20
Complexity: 304
Canonical SMILES: C1COCCN1P(=S)(N2CCOCC2)N3CCOCC3
InChI: InChI=1S/C12H24N3O3PS/c20-19(13-1-7-16-8-2-13,14-3-9-17-10-4-14)15-5-11-18-12-6-15/h1-12H2
InChIKey: JXAVLJWUECDWKI-UHFFFAOYSA-N

Thiophosphoric acid trimorpholide Toxicity Data With Reference

1.    

mor-ham-kdy 2500 µg/

    BJCAAI    British Journal of Cancer. 38 (1978),418.

Thiophosphoric acid trimorpholide Safety Profile

Mutation data reported. When heated to decomposition it emits toxic vapors of NOx, SOx and POx.

Thiophosphoric acid trimorpholide Specification

 Thiophosphoric acid trimorpholide (CAS NO.14129-98-7) is also called 4-27-00-00635 (Beilstein Handbook Reference) ; AI3-50979 ; BRN 0280156 ; NSC 202920 ; Phosphorothioic trimorpholide ; Morpholine, 4,4',4''-phosphinothioyldynetris- (9CI) ; Morpholine, 4,4',4''-phosphinothioylidynetris- ; Phosphine sulfide, trimorpholino- .

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