2-CHLORO-4-METHYL-6-(TRIFLUOROMETHYL)PYRIMIDINE
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2-CHLORO-4-METHYL-6-(TRIFLUOROMETHYL)PYRIMIDINE
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CAS No:
241164-09-0
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Formula:
C6H4ClF3N2
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Chemical Name:
2-CHLORO-4-METHYL-6-(TRIFLUOROMETHYL)PYRIMIDINE
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Synonyms:
2-CHLORO-4-METHYL-6-(TRIFLUOROMETHYL)PYRIMIDINE;2-Chloro-6-methyl-4-(trifluoromethyl)pyrimidine;2-Chloro-4-methyl-6-(trifluoromethyl)
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CAS No:
2-CHLORO-4-METHYL-6-(TRIFLUOROMETHYL)PYRIMIDINE Basic Attributes
196.5575696
196.001511
DTXSID20600561
Safety Information
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
2-CHLORO-4-METHYL-6-(TRIFLUOROMETHYL)PYRIMIDINE Use and Manufacturing
Step 2: Formation of 2-chloro-4-trifluoromethyl-6-alkyI pyrimidine[00223] To 2-hydroxy-4-trifluoromethyl-6-alkyl pyrimide (1 eq), was added POClThe following compounds may particularly be mentioned as examples of these substances: ... 2-chloro-4, 5-dimethyl-pyrimidine 2-chloro-4-methyl-5-ethyl-pyrimidine 2-chloro-4-ethyl-5-methyl-pyrimidine 2-chloro-4, 6-dimethyl-pyrimidine Step 2: Formation of 2-chloro-4-trifluoromethyl-6-alkyI pyrimidine[00223] To 2-hydroxy-4-trifluoromethyl-6-alkyl pyrimide (1 eq), was added POCl3 (5 eq). The mixture was stirred at reflux for overnight. After cooling to RT, the mixture was quenched with ice and neutralized with Sat. NaOH at O0C. After extracting with EtOAc, the organic phase was dried over Na2Stheta4 and concentrated. The residue was purified by column chromatography (Ethyl acetate:Hexane:l:4) to give the desired product. 2-Chloro-4-methyl-6-trifluoromethyl-pyrimidine[00228] Following the procedure in Example 25, using 4-methyl-6-trifluoromethyl-pyrimidin-2-ol as the starting material, the title compound was obtained as a brown oil (37% yield). This compound was not ionized in the LC-MS method. 1H NMR (CDCl3) delta 7.44 (s, IH), 2.68 (s, 3H).
Computed Properties
Molecular Weight:196.56
XLogP3:2.5
Hydrogen Bond Acceptor Count:5
Exact Mass:196.0015103
Monoisotopic Mass:196.0015103
Topological Polar Surface Area:25.8
Heavy Atom Count:12
Complexity:161
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Business licensed Certified factoryManufactory Supplier of 4-(Pentafluorothio)aniline,Pentafluoro,Pentafluorothio,Pentafluorosulfur,[4-(bromomethyl)phenyl]-pentafluoro-lambda6-sulfane,[4-(pentafluoro-sulfanyl)phenyl]acetic acidInquiryCAS No.: 241164-09-0Grade: Industrial GradeContent: 95%
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2-CHLORO-4-METHYL-6-(TRIFLUOROMETHYL)PYRIMIDINE
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