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O-(Benzotriazol-1-yl)-N,N,N',N'-tetra methyluronium tetrafluoroborate

O-(Benzotriazol-1-yl)-N,N,N',N'-tetra methyluronium tetrafluoroborate - CAS 125700-67-6

Catalog:	BB006235
Product Name:	O-(Benzotriazol-1-yl)-N,N,N',N'-tetra methyluronium tetrafluoroborate
CAS:	125700-67-6
Synonyms:	1-[Bis(dimethylamino)methylene]-1H-benzotriazolium 3-Oxide Tetrafluoroborate(1-) (1:1); 1-[Bis(dimethylamino)methylene]-1H-benzotriazolium 3-Oxide Tetrafluoroborate(1-); O-Benzotriazolyl Tetramethylisouronium Tetrafluoroborate; TBTU; 2-(1H-Benzotriazole-1-yl)-1,1,3,3-tetramethyluronium tetrafluoroborate; 2-(1h-benzo[d][1,2,3]triazol-1-yl)-1,1,3,3-tetramethyluronium tetrafluoroborate; o-(1h-benzotriazol-1-yl)-n,n,n',n'-tetramethyluronium tetrafluoroborate; MFCD00077413; N,N,N',N'-Tetramethyl-O-(benzotriazol-1-yl)uronium tetrafluoroborate; O-(benzotriazol-1-yl)-1,1,3,3-tetramethyluronium tetrafluoroborate

O-(Benzotriazol-1-yl)-N,N,N',N'-tetra methyluronium tetrafluoroborate

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Computed Properties

IUPAC Name:	[benzotriazol-1-yloxy(dimethylamino)methylidene]-dimethylazanium;tetrafluoroborate
Description:	O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Tetrafluoroborate is used in the synthesis of tetrapeptoid analogues of the antiprotocoal compound Apicidin. Also used in the synthesis of acid based t-antigen glycodendrimers.
Molecular Weight:	321.08
Molecular Formula:	C11H16N5O.BF4
Canonical SMILES:	[B-](F)(F)(F)F.CN(C)C(=[N+](C)C)ON1C2=CC=CC=C2N=N1
InChI:	InChI=1S/C11H16N5O.BF4/c1-14(2)11(15(3)4)17-16-10-8-6-5-7-9(10)12-13-16;2-1(3,4)5/h5-8H,1-4H3;/q+1;-1
InChI Key:	JKEKMBGUVUKMQB-UHFFFAOYSA-N
Melting Point:	205 °C (dec.)
Purity:	99 % (HPLC)
Solubility:	Soluble in Acetonitrile (100 mg/ml, clear, colorless), DMF (160.55 mg/ml, clear), Water (3 mg/ml at 20 °C)
Appearance:	White crystalline powder
Storage:	2-8 °C
MDL:	MFCD00077413
LogP:	1.34960

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