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1469801-67-9

1469801-67-9 Structure

1469801-67-9 Structure
IdentificationBack Directory
[Name]

(5R)-6,7-dihydro-5-(phenylmethyl)-2-(2,4,6-trimethylphenyl)-5H-Pyrrolo[2,1-c]-1,2,4-triazolium tetrafluoroborate
[CAS]

1469801-67-9
[Synonyms]

(R)-5-Benzyl-2-mesityl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate
(5R)-6,7-dihydro-5-(phenylmethyl)-2-(2,4,6-trimethylphenyl)-5H-Pyrrolo[2,1-c]-1,2,4-triazolium tetrafluoroborate
(5R)?-?5,?6-Dihydro-?5-?(phenylmethyl)?-?2-?(2,?4,?6-?trimethylphenyl)?-5H-?pyrrolo[2,?1-?c]?-?1,?2,?4-?triazolium Tetrafluoroborate
[Molecular Formula]

C21H24BF4N3
[MDL Number]

MFCD32671173
[MOL File]

1469801-67-9.mol
[Molecular Weight]

405.24
Chemical PropertiesBack Directory
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[InChI]

InChI=1/C21H24N3.BF4/c1-15-11-16(2)21(17(3)12-15)24-14-23-19(9-10-20(23)22-24)13-18-7-5-4-6-8-18;2-1(3,4)5/h4-8,11-12,14,19H,9-10,13H2,1-3H3;/q+1;-1/t19-;/s3
[InChIKey]

WXHVZXYVEMIPOO-JHTMQSDJNA-N
[SMILES]

[N+]1(C2=C(C)C=C(C)C=C2C)=CN2[C@@H](CC3=CC=CC=C3)CCC2=N1.[B-](F)(F)(F)F |&1:12,r|
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H314
[Precautionary statements ]

P501-P260-P264-P280-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P405
Spectrum DetailBack Directory
[Spectrum Detail]

(5R)-6,7-dihydro-5-(phenylmethyl)-2-(2,4,6-trimethylphenyl)-5H-Pyrrolo[2,1-c]-1,2,4-triazolium tetrafluoroborate(1469801-67-9)1HNMR
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