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ChemicalBook--->CAS DataBase List--->98946-18-0

98946-18-0

98946-18-0 Structure

98946-18-0 Structure
IdentificationMore
[Name]

tert-Butyl 2,2,2-trichloroacetimidate
[CAS]

98946-18-0
[Synonyms]

2,2,2-TRICHLOROACETIMIDIC ACID TERT-BUTYL ESTER
9-FLUORENYLMETHYL CARBAMATE
9-(FLUORENYLMETHYLCARBONYL) AMIDE
FMOC-AMIDE
FMOC-NH2
N-(9-FLUORENYLMETHOXYCARBONYL)AMIDE
O-TERT BUTYL-2,2,2-TRICHLOROACETIMIDATE
TBTA
T-BUTYL 2,2,2-TRICHLOROACETIMIDATE
TERT-BUTYL 2,2,2-TRICHLOROACETIMIDATE
TERT-BUTYL 2,2,2-TRICHLOROACETIMIDATE, 9 6%
T-BUTYL TRICHLOROACETIMIDATE
tert-Butyl 2,2,2-trichloroacetimidate 99%
tert-Butyl 2,2,2-trichloroacetimidate, GC 97%
Tert-Butyl 2,2,2-trichloroacetimidate, 97 %
tert-butyl 2,2,2-trichloroacetamide
Tris[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]amine
Trichloroacetimidic acid tert-butyl ester
[EINECS(EC#)]

629-631-5
[Molecular Formula]

C6H10Cl3NO
[MDL Number]

MFCD00237376
[Molecular Weight]

218.51
[MOL File]

98946-18-0.mol
Chemical PropertiesBack Directory
[Appearance]

Clear colorless to pale yellow liquid
[Melting point ]

21 °C(lit.)
[Boiling point ]

65 °C11 mm Hg(lit.)
[density ]

1.222
[refractive index ]

n20/D 1.456(lit.)
[Fp ]

131 °F
[storage temp. ]

2-8°C
[solubility ]

Soluble in organic solvents, cyclo hexane.
[form ]

Liquid or Low Melting Crystalline Mass
[pka]

2.49±0.70(Predicted)
[color ]

Clear colorless to pale yellow
[Specific Gravity]

1.222
[Sensitive ]

Moisture Sensitive
[BRN ]

1770049
[Stability:]

Hygroscopic
[InChIKey]

CQXDYHPBXDZWBA-UHFFFAOYSA-N
[CAS DataBase Reference]

98946-18-0(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R10:Flammable.
R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
S16:Keep away from sources of ignition-No smoking .
S36/37:Wear suitable protective clothing and gloves .
[RIDADR ]

UN 1993 3/PG 3
[WGK Germany ]

3
[F ]

10-21
[Hazard Note ]

Irritant/Moisture Sensitive
[TSCA ]

No
[HazardClass ]

3.2
[PackingGroup ]

III
[HS Code ]

29252900
Hazard InformationBack Directory
[Chemical Properties]

Clear colorless to pale yellow liquid
[Application]

Tert-Butyl 2,2,2-trichloroacetimidate can be used as a reagent for the preparation of tert-butyl esters, tert-butyl ethers and tert-butyl amines.
[Uses]

tert-Butyl 2,2,2-trichloroacetimidate is used to produce di-tert-butyl peroxide at temperature of -5°C. It may be used in the synthesis of N-α-Fmoc-phospho(1-nitrophenylethyl-2-cyanoethyl)-L-serine, caged building block. It may be used in the conversion of alcohols and carboxylic acids to their respective ethers and esters.
[Preparation]

Potassium t-Butoxide (1.68 g, 15 mmol) was dissolved in t-butanol (30 mL) and  this solution was added over 15 min to a stirred solution of Trichloroacetonitrile (21.6 g, 15 mL, 15 mmol) in dry diethyl ether (30 mL) cooled to 0 °C under nitrogen. The yellow mixture was allowed to warm to 20 °C over 1 h, and then heated to reflux for 1 h. After the reaction mixture had been cooled to rt, volatiles were removed on the rotary evaporator and the residual oil was dissolved in pentane (30 mL). The solution was filtered and the pentane was removed on the rotary evaporator. The residue was then distilled to yield 23 g (70%), bp 65-69 °C/12 mmHg, which solidified on storage.
Spectrum DetailBack Directory
[Spectrum Detail]

tert-Butyl 2,2,2-trichloroacetimidate(98946-18-0)1HNMR
tert-Butyl 2,2,2-trichloroacetimidate(98946-18-0)13CNMR
tert-Butyl 2,2,2-trichloroacetimidate(98946-18-0)FT-IR
tert-Butyl 2,2,2-trichloroacetimidate(98946-18-0)Raman
tert-Butyl 2,2,2-trichloroacetimidate(98946-18-0)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

tert-Butyl 2,2,2-trichloroacetimidate, 95%(98946-18-0)
[Alfa Aesar]

tert-Butyl 2,2,2-trichloroacetimidate, 97%(98946-18-0)
[Sigma Aldrich]

98946-18-0(sigmaaldrich)
[TCI AMERICA]

tert-Butyl 2,2,2-Trichloroacetimidate,>95.0%(GC)(98946-18-0)
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