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1-(4-TRIFLUOROMETHYL-PYRIMIDIN-2-YL)-PIPERIDIN-4-OL

1-(4-TRIFLUOROMETHYL-PYRIMIDIN-2-YL)-PIPERIDIN-4-OL structure

CAS No:
401930-07-2
Formula:
C10H12F3N3O
Chemical Name:
1-(4-TRIFLUOROMETHYL-PYRIMIDIN-2-YL)-PIPERIDIN-4-OL
Synonyms:
1-(4-TRIFLUOROMETHYL-PYRIMIDIN-2-YL)-PIPERIDIN-4-OL;1-[4-(TRIFLUOROMETHYL)-2-PYRIMIDINYL]-4-PIPERIDINOL;1-[4-(Trifluoromethyl)pyrimidin-2-yl]piperidin-4-ol 97%;1-[4-(Trifluoromethyl)pyrimidin-2-yl]piperidin-4-ol97%
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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1-(4-TRIFLUOROMETHYL-PYRIMIDIN-2-YL)-PIPERIDIN-4-OL Basic Attributes

Molecular Weight：

247.22

Exact Mass：

247.093246

DSSTox ID：

DTXSID50383810

Characteristics

PSA：

49.2

XLogP3：

1.4

Density：

1.383

Melting Point：

99 °C

Flash Point：

175.4±30.7 °C

Refractive Index：

1.514

Safety Information

Hazard note：

Harmful

1-(4-TRIFLUOROMETHYL-PYRIMIDIN-2-YL)-PIPERIDIN-4-OL Use and Manufacturing

Piperidin-4--ol (1.65 g, 16.3 mmol), 2—chioro-4-(trifluoromethyl)pyrimidine (2.98 g, 16.3 mmoi), and triethylamine (4.5 mL, 32.7 mmol) were refluxed in isopropanol (60 mU) for 5h. The reaction was cooled to room temperature and diluted with hexanes causing a white precipitate to fOrm. The solids were removed by filtration, and the filtrate was passed through a plug of silica, washing with 1: 1 EtOAc/hexanes and then EtOAc, The combined filtrate and washings were concentrated to dryness to afford 3, 89 g of the title compound. Exact mass calculated for C, 0H7F3N, O: 247, 09, found: LCMS rn/a = 248.2 [M±H1*.

Computed Properties

Molecular Weight:247.22
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:247.09324650
Monoisotopic Mass:247.09324650
Topological Polar Surface Area:49.2
Heavy Atom Count:17
Complexity:254
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-TRIFLUOROMETHYL-PYRIMIDIN-2-YL)-PIPERIDIN-4-OL

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Latest News
Learn More Other Chemicals

1-(4-TRIFLUOROMETHYL-PYRIMIDIN-2-YL)-PIPERIDIN-4-OL

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