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Succinimidyl 2,2,2-trichloroethyl carbonate

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Name

Succinimidyl 2,2,2-trichloroethyl carbonate

EINECS N/A
CAS No. 66065-85-8 Density 1.69 g/cm3
PSA 72.91000 LogP 1.51170
Solubility N/A Melting Point 111-113 °C(lit.)
Formula C7H6Cl3NO5 Boiling Point 327.5 °C at 760 mmHg
Molecular Weight 290.487 Flash Point 151.9 °C
Transport Information N/A Appearance N/A
Safety 26-27-28-36/37/39 Risk Codes 20/21/22-36/37
Molecular Structure Molecular Structure of 66065-85-8 (N-(2,2,2-TRICHLOROETHOXYCARBONYLOXY)SUCCINIMIDE) Hazard Symbols HarmfulXn
Synonyms

N-(2,2,2-Trichloroethoxycarbonyloxy)succinimide;

Article Data 5

Succinimidyl 2,2,2-trichloroethyl carbonate Specification

The Succinimidyl 2,2,2-trichloroethyl carbon, with the CAS registry number 66065-85-8, is also known as N-(2,2,2-Trichloroethoxycarbonyloxy)succinimide. This chemical's molecular formula is C7H6Cl3NO5 and molecular weight is 290.4852. Its IUPAC name is called 1-{[(2,2,2-trichloroethoxy)carbonyl]oxy}pyrrolidine-2,5-dione. The product should be sealed and stored in cool and dry place.

Physical properties of Succinimidyl 2,2,2-trichloroethyl carbon: (1)ACD/LogP: 0.62; (2)ACD/LogD (pH 5.5): 0.62; (3)ACD/LogD (pH 7.4): 0.62; (4)ACD/BCF (pH 5.5): 1.74; (5)ACD/BCF (pH 7.4): 1.74; (6)ACD/KOC (pH 5.5): 51.68; (7)ACD/KOC (pH 7.4): 51.68; (8)#H bond acceptors: 6; (9)#Freely Rotating Bonds: 4; (10)Index of Refraction: 1.55; (11)Molar Refractivity: 54.63 cm3; (12)Molar Volume: 171.4 cm3; (13)Surface Tension: 59.5 dyne/cm; (14)Density: 1.69 g/cm3; (15)Flash Point: 151.9 °C; (16)Enthalpy of Vaporization: 56.98 kJ/mol; (17)Boiling Point: 327.5 °C at 760 mmHg; (18)Vapour Pressure: 0.000201 mmHg at 25°C.

Preparation: this chemical can be prepared by N-hydroxy-succinimide and 1,1,1-trichloro-2-chlorocarbonyloxy-ethane. This reaction will need reagent triethylamine and solvent tetrahydrofuran. The reaction time is 1 hour. The yield is about 94%.

Uses of Succinimidyl 2,2,2-trichloroethyl carbon: it can be used to produce N-trichloroethoxycarbonyl-L-valine. This reaction will need reagent sodium bicarbonate and solvent H2O, tetrahydrofuran. The yield is about 79%.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. It is harmful by inhalation, in contact with skin and if swallowed. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1N(OC(=O)OCC(Cl)(Cl)Cl)C(=O)CC1
(2)InChI: InChI=1/C7H6Cl3NO5/c8-7(9,10)3-15-6(14)16-11-4(12)1-2-5(11)13/h1-3H2
(3)InChIKey: WBZXNGAFYBGQFE-UHFFFAOYAO

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