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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)-

Carbonochloridic acid, 3-(trifluoromethyl)phenyl ester

ClC(=O)Oc1cccc(c1)C(F)(F)F Request for Quotation
Chemical Name: Carbonochloridic acid, 3-(trifluoromethyl)phenyl ester
CAS Number: 95668-29-4
Product Number: AG003IB2(AGN-PC-0LLVUB)
Synonyms:
MDL No:
Molecular Formula: C8H4ClF3O2
Molecular Weight: 224.5644

Identification/Properties

Properties
Form:
Solid
Computed Properties
Molecular Weight:
224.563g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
223.985g/mol
Monoisotopic Mass:
223.985g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
217
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:
Danger
UN#:
3277
Hazard Statements:
H300+H310+H330-H314-H290
Precautionary Statements:
P501-P260-P270-P262-P234-P271-P264-P280-P284-P390-P361+P364-P303+P361+P353-P301+P330+P331-P301+P310+P330-P304+P340+P310-P305+P351+P338+P310-P403+P233-P406-P405
Class:
6.1,8
Packing Group:
Ⅱ

NMR Spectrum

Other Analytical Data

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Chemical Structure


3-(Trifluoromethyl)phenylchloroformate, also known as TFP-Cl, is a versatile chemical compound widely used in chemical synthesis for various applications. This reagent is primarily utilized as a powerful coupling agent in the preparation of amides, esters, and carbamates.TFP-Cl is particularly valuable in peptide synthesis, where it serves as an efficient acylating agent for forming amide bonds between amino acids. Its high reactivity and selectivity make it an excellent choice for synthesizing peptides with complex structures and sequences.In addition to peptide synthesis, TFP-Cl is also employed in the functionalization of alcohols, amines, and thiols to introduce various functional groups. This compound serves as a key intermediate in the preparation of pharmaceuticals, agrochemicals, and advanced materials.Furthermore, TFP-Cl is utilized in the modification of surfaces and polymers, enabling the introduction of specific chemical functionalities for tailored properties and applications. Its compatibility with a wide range of substrates and reagents makes it a valuable tool in the field of organic synthesis.Overall, 3-(Trifluoromethyl)phenylchloroformate plays a critical role in chemical synthesis, offering synthetic chemists a versatile and reliable tool for the efficient construction of complex molecules and materials with diverse applications.