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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Thiourea, [4-(trifluoromethoxy)phenyl]-

NC(=S)Nc1ccc(cc1)OC(F)(F)F Request for Quotation
Chemical Name: Thiourea, [4-(trifluoromethoxy)phenyl]-
CAS Number: 142229-74-1
Product Number: AG001I14(AGN-PC-0KKY68)
Synonyms:
MDL No:
Molecular Formula: C8H7F3N2OS
Molecular Weight: 236.2142

Identification/Properties

Computed Properties
Molecular Weight:
236.212g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
236.023g/mol
Monoisotopic Mass:
236.023g/mol
Topological Polar Surface Area:
79.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
226
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


1-(4-(Trifluoromethoxy)phenyl)thiourea is a versatile compound widely used in chemical synthesis. Its unique structure and properties make it a valuable tool in various chemical reactions and processes. One of its key applications is as a catalyst in organic transformations, where it can facilitate the formation of new bonds and promote specific reactions with high efficiency. Additionally, 1-(4-(Trifluoromethoxy)phenyl)thiourea is employed as a reagent in the synthesis of pharmaceuticals, agrochemicals, and other fine chemicals due to its ability to introduce the trifluoromethoxy group into organic molecules. The compound's high reactivity and selectivity make it a preferred choice for researchers and chemists seeking to access novel compounds and expand the frontiers of chemical synthesis.