ChemicalBook--->CAS DataBase List--->16075-42-6

16075-42-6

16075-42-6 Structure

16075-42-6 Structure
IdentificationMore
[Name]

2-Amino-4-(trifluoromethyl)pyrimidine
[CAS]

16075-42-6
[Synonyms]

2-AMINO-4-(TRIFLUOROMETHYL)PYRIMIDINE
4-(TRIFLUOROMETHYL)PYRIMIDIN-2-AMINE
4-(TRIFLUOROMETHYL)PYRIMIDIN-2-YLAMINE
AKOS B024896
ART-CHEM-BB B024896
BUTTPARK 27\08-65
2-Amino-4-(trifluoromethyl)pyrimidine 97%
2-Amino-4-(trifluoromethyl)pyrimidine97%
2-Amino-4-(trifluoromethyl)pyrimdine
[EINECS(EC#)]

623-256-0
[Molecular Formula]

C5H4F3N3
[MDL Number]

MFCD00828624
[Molecular Weight]

163.1
[MOL File]

16075-42-6.mol
Chemical PropertiesBack Directory
[Melting point ]

175-177°C
[Boiling point ]

260.7±50.0 °C(Predicted)
[density ]

1.460±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

1.90±0.10(Predicted)
[color ]

White to Light yellow
[λmax]

308nm(EtOH aq.)(lit.)
[InChI]

1S/C5H4F3N3/c6-5(7,8)3-1-2-10-4(9)11-3/h1-2H,(H2,9,10,11)
[InChIKey]

NKOTXYPTXKUCDL-UHFFFAOYSA-N
[SMILES]

Nc1nccc(n1)C(F)(F)F
[CAS DataBase Reference]

16075-42-6(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

2811
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[PackingGroup ]

Ⅲ
[HS Code ]

29335990
[Storage Class]

6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
[Hazard Classifications]

Acute Tox. 2 Oral
Aquatic Acute 1
Eye Irrit. 2
Resp. Sens. 1
Hazard InformationBack Directory
[Chemical Properties]

White to brown powder
[Synthesis]

1-Ethoxy-3-trifluoromethyl-1,3-butadiene

59938-06-6

guanidine

113-00-8

2-Amino-4-(trifluoromethyl)pyrimidine

16075-42-6

Step 2: To a solution of compound [63] (22.8 g, 2.4 mmol, 1 eq.) in anhydrous ethanol (100 mL), NaOH granules (9.55 g, 238 mmol, 1 eq.) were added and the reaction mixture was stirred for 16 h at room temperature. Subsequently, a solution of compound [84] was slowly added through a dropping funnel over a period of 2 hours. After addition, the reaction mixture was continued to be stirred for 2 hours. Upon completion of the reaction, the solvent was removed by evaporation and the residue was dissolved in water (500 mL) with vigorous stirring for 2 hours, followed by standing at room temperature overnight. The precipitate precipitated was collected by filtration and dried under vacuum to give compound [85] as a light yellow solid (20.6 g, 53% yield).

[References]

[1] Patent: WO2014/16849, 2014, A2. Location in patent: Page/Page column 117
Spectrum DetailBack Directory
[Spectrum Detail]

2-Amino-4-(trifluoromethyl)pyrimidine(16075-42-6)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2-Amino-4-(trifluoromethyl)pyrimidine(16075-42-6)
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