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| CAS No.: | 13752-51-7 |
|---|---|
| Name: | 4-[(4-Morpholinylthio)thioxomethyl]-morpholine |
| Article Data: | 5 |
| Molecular Structure: | |
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| Formula: | C9H16N2O2S2 |
| Molecular Weight: | 248.37 |
| Synonyms: | Morpholine,4-[(4-morpholinylthio)thioxomethyl]- (9CI);Morpholine,4-[(morpholinothiocarbonyl)thio]- (8CI);4-[(Morpholinothio)thiocarbonyl]morpholine;Accelerator OTOS;Cure-rite 18;Curite 18;N,N:N',N'-Bis(oxydiethylene)thiocarbamoylsulfenamide;N,N'-Bis(oxydiethylene)thiocarbamoylsulfenamide;N,N'-[(Thiocarbonyl)thio]dimorpholine;N-Oxydiethylene thiocarbamyl-N-oxydiethylenesulfenamide;N-Oxydiethylenethiocarbamoyl-N'-oxydiethylenesulfenamide;OTOS; |
| EINECS: | 237-335-9 |
| Density: | 1.34 g/cm3 |
| Melting Point: | 139 °C |
| Boiling Point: | 378.1 °C at 760 mmHg |
| Flash Point: | 182.4 °C |
| Solubility: | 127mg/L at 20℃ |
| PSA: | 82.33000 |
| LogP: | 0.45970 |
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morpholine
- 72087-88-8
acetyl-trichloromethyl-disulfane
- 13752-51-7
4-(morpholine-4-carbothioylsulfanyl)-morpholine
| Conditions | Yield |
|---|---|
| In diethyl ether Mechanism; further α-chloroalkyd disulfides, <18 deg C; | 32% |
| In diethyl ether <18 deg C; | 22% |
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Consensus Reports
Reported in EPA TSCA Inventory.
Specification
The N-Oxydiethylenethiocarbamoyl-N-oxydiethylene sulfenamide is an organic compound with the formula C9H16N2O2S2. The IUPAC name of this chemical is morpholin-4-yl morpholine-4-carbodithioate. With the CAS registry number 13752-51-7, it is also named as 4-[(morpholin-4-ylcarbonothioyl)sulfanyl]morpholine. The product's classification codes are Mutation data; Reproductive Effect.
Physical properties about N-Oxydiethylenethiocarbamoyl-N-oxydiethylene sulfenamide are: (1)ACD/LogP: -0.90; (2)ACD/LogD (pH 5.5): -0.9; (3)ACD/LogD (pH 7.4): -0.9; (4)ACD/BCF (pH 5.5): 1; (5) ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 7.69; (7)ACD/KOC (pH 7.4): 7.69; (8)#H bond acceptors: 4; (9)#H bond donors: 0; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 82.33 Å2; (12)Index of Refraction: 1.631; (13)Molar Refractivity: 66 cm3; (14)Molar Volume: 185 cm3; (15)Polarizability: 26.16×10-24cm3; (16)Surface Tension: 64.1 dyne/cm; (17)Density: 1.34 g/cm3; (18)Flash Point: 182.4 °C; (19)Enthalpy of Vaporization: 62.59 kJ/mol; (20)Boiling Point: 378.1 °C at 760 mmHg; (21)Vapour Pressure: 6.45E-06 mmHg at 25°C.
Preparation: this chemical can be prepared by morpholine and acetyl-trichloromethyl-disulfane. This reaction will need solvent diethyl ether. The reaction temperature is <18 °C. The yield is about 22%.
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You can still convert the following datas into molecular structure:
(1)SMILES: S=C(SN1CCOCC1)N2CCOCC2
(2)InChI: InChI=1/C9H16N2O2S2/c14-9(10-1-5-12-6-2-10)15-11-3-7-13-8-4-11/h1-8H2
(3)InChIKey: HOEFWOBLOGZQIQ-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C9H16N2O2S2/c14-9(10-1-5-12-6-2-10)15-11-3-7-13-8-4-11/h1-8H2
(5)Std. InChIKey: HOEFWOBLOGZQIQ-UHFFFAOYSA-N