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667080

Sigma-Aldrich

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%

Synonym(s):

2-Pentafluorophenyl-6.10b-dihydro-4H,5aH-5-oxo-3,10c-diaza-2-azoniacyclopenta[c]fluorene tetrafluoroborate

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About This Item

Empirical Formula (Hill Notation):
C18H11BF9N3O
CAS Number:
Molecular Weight:
467.10
MDL number:
UNSPSC Code:
12352005
PubChem Substance ID:

assay

97%

mp

235 °C (dec.)

storage temp.

2-8°C

SMILES string

F[B-](F)(F)F.Fc1c(F)c(F)c(c(F)c1F)-[n+]2c[n@H]3[C@H]4[C@H](Cc5ccccc45)OCc3n2

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

InChI key

CPCMDOOTVHDRTM-OUYNRQGDSA-N


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