1-(TRIFLUOROMETHYL)-1,2-BENZIODOXOL-3(1H)-ONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H4F3IO2
Molecular Weight	316.0158
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(TRIFLUOROMETHYL)-1,2-BENZIODOXOL-3(1H)-ONE

Structure Search

SMILES

FC(F)(F)I1OC(=O)C2=C1C=CC=C2

InChI

InChIKey=XHEOXSQMBWJOKP-UHFFFAOYSA-N

InChI=1S/C8H4F3IO2/c9-8(10,11)12-6-4-2-1-3-5(6)7(13)14-12/h1-4H

HIDE SMILES / InChI

Molecular Formula	C8H4F3IO2
Molecular Weight	316.0158
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:58:31 GMT 2025` Edited by `admin` on `Mon Mar 31 22:58:31 GMT 2025`
Record UNII	DHY074A7WG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-(TRIFLUOROMETHYL)-1,2-BENZIODOXOL-3(1H)-ONE

Systematic Name

English

TOGNI'S REAGENTS CARBONYL COMPOUND [MI]

Preferred Name

English

TOGNI'S REAGENTS, CARBONYL COMPOUND-

Common Name

English

1,2-BENZIODOXOL-3(1H)-ONE, 1-(TRIFLUOROMETHYL)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

24850981

Created by admin on Mon Mar 31 22:58:31 GMT 2025 , Edited by admin on Mon Mar 31 22:58:31 GMT 2025

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CAS

887144-94-7

Created by admin on Mon Mar 31 22:58:31 GMT 2025 , Edited by admin on Mon Mar 31 22:58:31 GMT 2025

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MERCK INDEX

m10933

Created by admin on Mon Mar 31 22:58:31 GMT 2025 , Edited by admin on Mon Mar 31 22:58:31 GMT 2025

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Merck Index

WIKIPEDIA

Togni reagent II

Created by admin on Mon Mar 31 22:58:31 GMT 2025 , Edited by admin on Mon Mar 31 22:58:31 GMT 2025

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FDA UNII

DHY074A7WG

Created by admin on Mon Mar 31 22:58:31 GMT 2025 , Edited by admin on Mon Mar 31 22:58:31 GMT 2025

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