[Bis(trifluoroacetoxy)iodo]benzene, 97%

Name: [Bis(trifluoroacetoxy)iodo]benzene, 97%
Brand: Vaqora Chemicals
SKU: VQ-010687

About [Bis(trifluoroacetoxy)iodo]benzene, 97%

Listed under CAS 2712-78-9, [Bis(trifluoroacetoxy)iodo]benzene is a fluorinated building block available from Vaqora Chemicals, specified at 97% purity. With the molecular formula C10H5F6IO4, it has a molar mass of 430.04 g/mol. Systematically, it is named [phenyl-(2,2,2-trifluoroacetyl)oxy-lambda3-iodanyl] 2,2,2-trifluoroacetate. Alternative names: BTI and Iodobenzene I,I-bis(trifluoroacetate).

In its supplied form it is white to light yellow powder or crystalline powder or chunks. Key physical data: a melting point of 121-125 °C. Store in a tightly closed container in a cool, dry and well-ventilated place. The GHS classification uses the signal word “Warning”, so appropriate gloves, eye protection and ventilation are recommended.

Key uses span organic synthesis and API synthesis. Our customers for this product work in pharmaceutical manufacturing, academic and industrial research and agrochemical production.

Vaqora Chemicals supplies [Bis(trifluoroacetoxy)iodo]benzene in 10 g, 50 g and 1 kg packs, each shipped with a Certificate of Analysis (COA), and exports worldwide.

Typical applications

Organic synthesis
API synthesis

Industries

Specifications & identifiers

Chemical identifiers
Product name	[Bis(trifluoroacetoxy)iodo]benzene, 97%
Catalogue No.	VQ-010687
CAS Number	2712-78-9
IUPAC name	[phenyl-(2,2,2-trifluoroacetyl)oxy-lambda3-iodanyl] 2,2,2-trifluoroacetate
Molecular formula	C₁₀H₅F₆IO₄
Molecular weight	430.04 g/mol
Exact mass	429.9137
Purity / assay	97%
HSN code	29033990
InChIKey	PEZNEXFPRSOYPL-UHFFFAOYSA-N
SMILES	C1=CC=C(C=C1)I(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F
PubChem CID	102317

Physical properties
Physical form	Powder
Appearance	White to light yellow powder or crystalline powder or chunks
Melting point	121-125 °C
LogP (XLogP3)	5
H-bond donors / acceptors	0 / 10
TPSA	52.6 Å²
Synonyms	BTI, Iodobenzene I,I-bis(trifluoroacetate), PIFA, (Bis(trifluoroacetoxy)iodo)benzene, Bis(I,I-trifluoroacetoxy)iodobenzene, TAIB cpd, Iodine, phenylbis(trifluoroacetato-kappaO)-, iodobenzene bis(trifluoroacetate), PhI(OCOCF3)2, Iodine, phenylbis(trifluoroacetato-O)-, phenyliodine bis(trifluoroacetate), I,I-bis(trifluoroacetoxy)iodobenzene

Safety & hazard information (GHS)

Harmful / irritant

Signal word: Warning

Hazard statements

H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation

Precautionary statements: P261, P264, P264 + P265, P271, P280, P302 + P352, P304 + P340, P305 + P351 + P338, P319, P321, P332 + P317, P337 + P317, P362 + P364, P403 + P233, P405, P501

Classification is indicative (aggregated GHS notifications) and may vary by grade and concentration. Always refer to the SDS supplied with your lot.

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of [Bis(trifluoroacetoxy)iodo]benzene, 97%?

The CAS Registry Number of [Bis(trifluoroacetoxy)iodo]benzene, 97% is 2712-78-9. It is also known as BTI, Iodobenzene I,I-bis(trifluoroacetate), PIFA.

What is the molecular formula and molecular weight of [Bis(trifluoroacetoxy)iodo]benzene, 97%?

[Bis(trifluoroacetoxy)iodo]benzene, 97% has the molecular formula C10H5F6IO4 and a molecular weight of 430.04 g/mol. Its IUPAC name is [phenyl-(2,2,2-trifluoroacetyl)oxy-lambda3-iodanyl] 2,2,2-trifluoroacetate.

Which grade and pack sizes of [Bis(trifluoroacetoxy)iodo]benzene, 97% can I order?

We supply [Bis(trifluoroacetoxy)iodo]benzene, 97% in (97%) grade, in 10 g, 50 g, 1 kg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with [Bis(trifluoroacetoxy)iodo]benzene, 97%?

Yes. Every lot of [Bis(trifluoroacetoxy)iodo]benzene, 97% is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can [Bis(trifluoroacetoxy)iodo]benzene, 97% be shipped internationally?

Yes. [Bis(trifluoroacetoxy)iodo]benzene, 97% is classified as hazardous, so it is packed in UN-approved packaging and shipped as dangerous goods under IATA/IMDG rules. We export worldwide on EXW, FOB, CIF and DAP terms.