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125700-69-8

125700-69-8 Structure

125700-69-8 Structure
IdentificationMore
[Name]

N,N,N',N'-Tetramethyl-O-(3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl)uronium tetrafluoroborate
[CAS]

125700-69-8
[Synonyms]

N,N,N',N'-TETRAMETHYL-O-(3,4-DIHYDRO-4-OXO-1,2,3-BENZOTRIAZIN-3-YL) URONIUM TETRAFLUOROBORATE
O-(3,4-DIHYDRO-4-OXO-1,2,3-BENZOTRIAZIN-3-YL)-N,N,N',N'-TETRAMETHYLURONIUMTETRAFLUOROBORATE
O-(4-OXO-1,2,3-BENZOTRIAZIN-3(4H)-YL)-N,N,N',N'-TETRAMETHYLURONIUM TETRAFLUOROBORATE
TDBTU
O-(3,4-dihydro-4-oxo-1,2,3-*benzotriazin-3-yl)-N,
O-(3,4-dihydro-4-oxo-benzotriazin-3-yl)-tetrame.uronium bf4
O-(3,4-DIHYDRO-4-OXO-1,2,3-BENZOTRIAZIN-3-YL)-N,N,
O-(3,4-Dihydro-4-oxo-1,2,3-benzotriazin-3-yl)-N,N,N',N'-tetramethyluronium tetra
O-(3,4-DIHYDRO-4-OXO-1,2,3-BENZOTRIZIN-3-YL)-N,N,N',N'-TETRAMETHYLURONIUMTETRAFLUOROBORATE
TDBTU N,N,N'',N''-TETRAMETHYL-O-(3,4-DIHYDRO-4-OXO-1,2,3-BENZOTRIAZIN-3-YL) URONIUMTETRAFLUOROBORATE
N,N,N'',N''-TETRAMETHYL-O-(3,4-DIHYDRO-4-OXO-1,2,3-BENZOTRIAZIN-3-YL)URONIUM TETRAFLUOROBORATE(TDBTU)
2-(3,4-DIHYDRO-4-OXO-1,2,3-BENZOTRIAZIN-3-YL)-N,N,N'',N''-TETRAMETHYLURONIUM TETRAFLUOROBORATE
2-(3,4-DIHYDRO-4-OXO-BENZOTRIAZIN-3-YL)TETRAMETHYLURONIUM TETRAFLUOROBORATE
dihydrooxobenzotriazinyl tetramethyluronium fluoroborate
TDBTU, O-(4-Oxo-1,2,3-benzotriazin-3(4H)-yl)-N,N,Nμ,Nμ,-tetramethyluronium tetrafluoroborate, N,N,Nμ,Nμ-Tetramethyl-O-(3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl)uronium tetrafluoroborate
2-(3,4-Dihydro-4-oxo-benzotriazin-3-yl)tetramethyluronium tetraf
[Molecular Formula]

C12H16BF4N5O2
[MDL Number]

MFCD00077730
[Molecular Weight]

349.09
[MOL File]

125700-69-8.mol
Chemical PropertiesBack Directory
[Melting point ]

147 °C (dec.)
[storage temp. ]

2-8°C
[solubility ]

acetonitrile: 0.1 g/mL, clear
[form ]

Powder or Solid
[color ]

White to yellow
[Sensitive ]

Moisture & Light Sensitive
[InChI]

InChI=1S/C12H16N5O2.BF4/c1-15(2)12(16(3)4)19-17-11(18)9-7-5-6-8-10(9)13-14-17;2-1(3,4)5/h5-8H,1-4H3;/q+1;-1
[InChIKey]

FOBCPCIJLQTYBT-UHFFFAOYSA-N
[SMILES]

C12C=CC=CC=1N=NN(O/C(=[N+](/C)\C)/N(C)C)C2=O.[B-](F)(F)(F)F
[CAS DataBase Reference]

125700-69-8(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R37:Irritating to the respiratory system.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[RIDADR ]

UN 1759 8/PG III
[WGK Germany ]

3
[F ]

8-10-21
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29339900
Hazard InformationBack Directory
[Chemical Properties]

Beige crystalline
[Uses]

O-(3,4-Dihydro-4-oxo-1,2,3-benzotriazin-3-yl)-N,N,N?,N?-tetramethyluronium tetrafluoroborate (2-(3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl)-1,1,3,3-tetramethyluronium tetrafluoroborate, TBTU) may be used as coupling reagent in the synthesis of macrocyclic polyamine derivatives with various length of linkers, condensation reagent in the large-scale preparation of the hematoregulatory nonapeptide (Glp-Glu-Asp)2-DAS-(Lys)2 (2,SK&F 107647), coupling reagent for peptide synthesis which best suppresses racemization during fragment condensation.
Spectrum DetailBack Directory
[Spectrum Detail]

N,N,N',N'-Tetramethyl-O-(3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl)uronium tetrafluoroborate(125700-69-8)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

125700-69-8(sigmaaldrich)
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