ChemicalBook--->CAS DataBase List--->1391728-13-4

1391728-13-4

1391728-13-4 Structure

1391728-13-4 Structure
IdentificationBack Directory
[Name]

1-Fluoro-3,3-dimethyl-1,2-benziodoxole
[CAS]

1391728-13-4
[Synonyms]

1-Fluoro-3,3-dimethyl-1,2-benziodoxole
1-Fluoro-3,3-dimethyl-1,2-benziodoxole>
1-fluoro-3,3-dimethyl-1$l^{3},2-benziodoxole
1,2-Benziodoxole, 1-fluoro-1,3-dihydro-3,3-dimethyl-
1-Fluoro-3,3-dimethyl-1,3-dihydro-1λ3,2-benziodoxole
[EINECS(EC#)]

811-072-5
[Molecular Formula]

C9H10FIO
[MDL Number]

MFCD28397076
[MOL File]

1391728-13-4.mol
[Molecular Weight]

280.08
Chemical PropertiesBack Directory
[Melting point ]

85.0 to 89.0 °C
[solubility ]

soluble in Methanol
[form ]

powder to crystaline
[color ]

White to Orange to Green
[InChI]

InChI=1S/C9H10FIO/c1-9(2)7-5-3-4-6-8(7)11(10)12-9/h3-6H,1-2H3
[InChIKey]

FISITPXJYDTLHI-UHFFFAOYSA-N
[SMILES]

I1(F)C2=CC=CC=C2C(C)(C)O1
Safety DataBack Directory
[Symbol(GHS) ]

Flame Over Circle (GHS03)
GHS03
[Signal word ]

Danger
[Hazard statements ]

H272
[Precautionary statements ]

P210
[HS Code ]

2934999090
Hazard InformationBack Directory
[Uses]

1-Fluoro-3,3-dimethylbenziodoxole is a crystalline, off-white solid which can be handled under air for extended periods without noticeable hydrolytic decomposition. In the presence of excess fluoride ions (provided by triethylamine-hydrogen fluoride complexes), it can effectively function as an electrophilic fluorination reagent for easily enolizable diketo substrates, or it can engage in silver catalyzed difluorination of styrenes.
[reaction suitability]

reaction type: C-C Bond Formation
Spectrum DetailBack Directory
[Spectrum Detail]

1-Fluoro-3,3-dimethyl-1,2-benziodoxole(1391728-13-4)1HNMR
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