ChemicalBook--->CAS DataBase List--->740816-14-2

740816-14-2

740816-14-2 Structure

740816-14-2 Structure
IdentificationBack Directory
[Name]

(5AS, 10BR)-(-)-5A,10B-DIHYDRO-2-(PENTAFLUOROPHENYL)-4H,6H-INDENO[2,1-B][1,2,4]TRIZOLO[4,3-D][1,4]OXAZINIUM TETRAFLUOROBORATE
[CAS]

740816-14-2
[Synonyms]

5a(S),10b(R)-5a,10b-Dihydro-2-(pentafluorophenyl)-4H,6H-indeno[2
2-PENTAFLUOROPHENYL-6.10B-DIHYDRO-4H,5AH-5-OXO-3,10C-DIAZA-2-AZONIACYCLOPENTA[C]FLUORENE TETRAFLUOROBORATE
5A(S),10B(R)-5A,10B-DIHYDRO-2-(PENTAFLUOROPHENYL)-4H, 6H-INDENO(2,1-B)(1,2,4)TRIAZOLO(4,3-D)(1,4)OXAZINIUM TETRAFLUOROB
5A(S),10B(R)-5A,10B-DIHYDRO-2-(PENTAFLUOROPHENYL)-4H,6H-INDENO[2,1-B][1,2,4]TRIAZOLO[4,3-D][1,4]OXAZINIUM TETRAFLUOROBORATE
(5AS, 10BR)-(-)-5A,10B-DIHYDRO-2-(PENTAFLUOROPHENYL)-4H,6H-INDENO[2,1-B][1,2,4]TRIZOLO[4,3-D][1,4]OXAZINIUM TETRAFLUOROBORATE
5a(S),10b(R)-5a,10b-Dihydro-2-(pentafluorophenyl)-4H,6H-indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazinium tetrafluoroborate 97%
(5aS,10bR)-(-)-5a,10b-Dihydro-2-(pentafluorophenyl)-4H,6H-indeno[2,1-b][1,2,4]trizolo[4,3-d][1,4]oxaziniumtetrafluoroborate,min.98%
(5aS,10bR)-5a,10b-dihydro-2-(2,3,4,5,6-pentafluorophenyl)-4H,6H-Indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazinium tetrafluoroborate
(5aS, 10bR)-(-)-5a,10b-Dihydro-2-(pentafluorophenyl)-4H,6H-indeno[2,1-b][1,2,4]trizolo[4,3-d][1,4]oxazinium tetrafluoroborate, min. 98%
(5aS, 10bR)-(-)-5a,10b-Dihydro-2-(pentafluorophenyl)-4H,6H-indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazinium tetrafluoroborate, min. 98%
(5aS,10bR)-5a,10b-Dihydro-2-(2,3,4,5,6-pentafluorophenyl)-4H,6H-indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazinium Tetrafluoroborate,99%e.e.
(5aS,10bR)-(-)-5a,10b-Dihydro-2-(pentafluorophenyl)-4H,6H-indeno[2,1-b]
[1,2,4]trizolo[4,3-d][1,4]oxazinium tetrafluoroborate, min. 98%
(5aR,10bS)-(+)-5a,10b-Dihydro-2-(pentafluorophenyl)-4H,6H-indeno[2,1-b]
[1,2,4]triazolo[4,3-d][1,4]oxazinium tetrafluoroborate, min. 98%
[Molecular Formula]

C18H11BF9N3O
[MDL Number]

MFCD08459334
[MOL File]

740816-14-2.mol
[Molecular Weight]

467.1
Chemical PropertiesBack Directory
[Melting point ]

235 °C (dec.)
[storage temp. ]

2-8°C
[form ]

Powder
[color ]

light brown
[Optical Rotation]

Consistent with structure
[InChI]

1S/C18H11F5N3O.BF4/c19-12-13(20)15(22)18(16(23)14(12)21)26-7-25-11(24-26)6-27-10-5-8-3-1-2-4-9(8)17(10)25;2-1(3,4)5/h1-4,7,10,17H,5-6H2;/q+1;-1/t10-,17+;/m0./s1
[InChIKey]

CPCMDOOTVHDRTM-UIMCRZNENA-N
[SMILES]

[N+]1(C2C(F)=C(F)C(F)=C(F)C=2F)=CN2C(=N1)CO[C@@]1([H])CC3C=CC=CC=3[C@@]21[H].[B-](F)(F)(F)F |&1:18,27,r|
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Questions And AnswerBack Directory
[Reaction]

  1. Reagent used in the highly enantioand diastereoselective, catalytic intramolecular Stetter reaction.
  2. Direct synthesis of α-protio and α-deuterio α-chloro and α-fluoro carboxylic acids via assymetric hydration.
  3. Chemoselective conversion of α-unbranched aldehydes to amides.
Reactions of 740816-14-2
Spectrum DetailBack Directory
[Spectrum Detail]

(5AS, 10BR)-(-)-5A,10B-DIHYDRO-2-(PENTAFLUOROPHENYL)-4H,6H-INDENO[2,1-B][1,2,4]TRIZOLO[4,3-D][1,4]OXAZINIUM TETRAFLUOROBORATE(740816-14-2)1HNMR
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