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1-Trifluoromethyl-3,3-dimethyl-1,2-benziodoxole - >97.0%(HPLC), high purity , CAS No.887144-97-0

≥97%(HPLC)

CAS#: 887144-97-0
Formula: C₁₀H₁₀F₃IO
Molecular Weight: 330.09
MDL number: MFCD10567056
PubChem CID: 16043572
PubChem SID: 488199022

Item Number

T162595

Grouped product items
SKU	Size	Availability	Price
T162595-250mg	250mg	In stock	$63.90
T162595-1g	1g	In stock	$194.90
T162595-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$679.90
T162595-10g	10g	In stock	$1,222.90

View related series

Hypervalent iodine compounds

Basic Description

Synonyms	887144-97-0\|3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole\|1-Trifluoromethyl-3,3-dimethyl-1,2-benziodoxole\|Togni's Reagent\|1,2-Benziodoxole, 3,3-dimethyl-1-(trifluoromethyl)-\|1,3-Dihydro-3,3-dimethyl-1-(trifluoromethyl)-1,2-benziodoxole\|Togni Reagent\|U
Specifications & Purity	>97.0%(HPLC)
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice

Names and Identifiers

Pubchem Sid	488199022
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488199022
IUPAC Name	3,3-dimethyl-1-(trifluoromethyl)-1λ3,2-benziodoxole
INCHI	InChI=1S/C10H10F3IO/c1-9(2)7-5-3-4-6-8(7)14(15-9)10(11,12)13/h3-6H,1-2H3
InChi Key	HVAPLSNCVYXFDQ-UHFFFAOYSA-N
Canonical SMILES	CC1(C2=CC=CC=C2I(O1)C(F)(F)F)C
Isomeric SMILES	CC1(C2=CC=CC=C2I(O1)C(F)(F)F)C
WGK Germany	3
PubChem CID	16043572
Molecular Weight	330.09
Reaxy-Rn	10663510

Certificates

Certificate of Analysis(COA)

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7 results found

Lot Number	Certificate Type	Date	Item
B2311807	Certificate of Analysis	Jan 12, 2024	T162595
B2311806	Certificate of Analysis	Nov 17, 2023	T162595
B2311808	Certificate of Analysis	Nov 17, 2023	T162595
B2311825	Certificate of Analysis	Nov 17, 2023	T162595
A2203440	Certificate of Analysis	Jul 12, 2023	T162595
A2203441	Certificate of Analysis	Jul 12, 2023	T162595
A2203443	Certificate of Analysis	Jul 12, 2023	T162595

Sensitivity

heat & Moisture &light sensitive

Melt Point(°C)

75-80°C

Safety and Hazards(GHS)

Pictogram(s)	GHS07, GHS02
Signal	Warning
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation H228:Flammable solid
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P378:In case of fire: Use ... to extinguish. P210:Keep away from heat, hot surface, sparks, open flames and other ignition sources. - No smoking. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P240:Ground/bond container and receiving equipment. P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P241:Use explosion-proof [electrical/ventilating/lighting/.../] equipment. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.
WGK Germany	3
Reaxy-Rn	10663510

References

1. Patrick Eisenberger, Iris Kieltsch, Nicolas Armanino, Antonio Togni,. (2008-03-21) Mild electrophilic trifluoromethylation of secondary and primary aryl- and alkylphosphines using hypervalent iodine(iii)-CF(3) reagents.. Chemical communications (Cambridge, England), 13 ((13)): ( 1575-1577 ). [PMID:18354804]

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