UCSF

ZINC00156069

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 No

CAS Numbers: 125700-67-6 , 26198-19-6 , 94790-37-1 , 948292-28-2

Other Names:

"O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate, 99%"

"O-Benzotriazole-N,N,N',N'-tetramethyluronium hexafluorophosphate, 99%"

2- -1,1,3,3-tetramethyluroniumtetrafluoroborate

2-(1H-BENZOTRIAZOL-1-YL)-1,1,3,3-TETRAMETHYLURONIU

2-(1H-BENZOTRIAZOL-1-YL)-1,1,3,3-TETRAMETHYLURONIUM TETRAFLUOROBORATE

2-(1H-Benzotriazole-1-yl)-1,1,3,3-tetramethyl uronium hexafluorophosphate

2-(1H-Benzotriazole-1-yl)-1,1,3,3-tetramethyl uronium tetrafluoroborate

2-(1H-Benzotriazole-1-yl)-1,1,3,3-tetramethyluronium hexafluorophosphate

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

5-(2,4-Dimethoxy-phenyl)-2H-pyrazol-3-ylamine hydr

5-(2,4-Dimethoxy-phenyl)-2H-pyrazol-3-ylamine hydrochloride

hexafluorophosphate

KNORR REAGENT; 2-(1H-BENZOTRIAZOLE-1-YL)-1,1,3,3-TETRAMETHYLAMINIUM TETRAFLUOROBORATE; 2-(1H-BENZOTRIAZOL-1-YL)-1,1,3,3-TETRAMETHYLURONIUM TETRAFLUOROBORATE; N-[(1H-BENZOTRIAZOL-1-YL)(DIMETHYLAMINO)-METHYLENE]-N-METHYLMETHANAMINIUM TETRAFLUOROBORATE N-OXI

MFCD00075445

MFCD00077413

NA

O-(1H-Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate

O-(1H-Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate, 98%

O-(1H-Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate

O-(1H-Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate, 99%

O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium

O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate

O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Hexafluorophosphate [Coupling Reagent for Peptide]

O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate, 98%

O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate

O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Tetrafluoroborate [Coupling Reagent for Peptide]

O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate, 99%

O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluroniumhexafluorophosphate

O-(Benzotriazol-1-yl)-N,N,N'N,'-tetramethyluronium

O-(Benzotriazol-1-yl)-N,N,N,N-tetramethyluronium hexafluorophosphate

O-(Benzotriazol-1-yl)-N,N,N,N-tetramethyluronium tetrafluoroborate

O-(Benzotriazol-1-yl)-N,N,N¡ä,N¡ä-tetramethyluronium hexafluorophosphate

O-(Benzotriazol-1-yl)-N,N,N¡ä,N¡ä-tetramethyluronium tetrafluoroborate

O-Benzotriazol-1-yl-N,N,N',N'-tetramethyluronium hexafluorophosphate

O-Benzotriazol-1-yl-N,N,N',N'-tetramethyluronium Tetrafluoroborate

O-Benzotriazol-1-yl-N,N,N`,N`-tetramethyluronium Tetrafluoroborate (TBTU)

O-Benzotriazole-N,N,N',N'-tetramethyluronium Hexafluorophosphate

o-Benzotriazole-N,N,N¡¯,N¡¯-tetramethyl-uronium-hexafluoro-phosphate)

ST-8094

TBTU

TBTU;; O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate

tetrafluoroborate

[(1H-1,2,3-benzotriazol-1-yloxy)(dimethylamino)methylidene]dimethylazanium; tetrafluoroboranuide

[[2H-benzotriazol-4-yl(methyl)amino]-methoxy-methylene]-dimethyl-ammonium; fluoro-dioxido-oxo-$l^{5}-phosphane

[[2H-benzotriazol-4-yl(methyl)amino]-methoxymethylidene]-dimethylammonium; fluoro-dioxido-oxophosphorane

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -1.91 4.96 -13.76 0 6 0 48 234.283 1
Ref Reference (pH 7) -2.72 6.91 -27.09 0 6 1 46 234.283 3
Mid Mid (pH 6-8) -1.91 5.11 -10.15 1 6 0 50 235.291 1
Mid Mid (pH 6-8) -1.91 6.21 -32.34 1 6 0 50 235.291 1
Lo Low (pH 4.5-6) -1.91 6.34 -40.96 2 6 0 51 236.299 1

Vendor Notes

Note Type Comments Provided By
Melting_Point 195-198? dec. Alfa-Aesar
Melting_Point 195-198° dec. Alfa-Aesar
MP 200 - 202 Enamine Building Blocks
MP 200...202 Enamine Building Blocks
MP 203° Oakwood Chemical
MP 205°(dec.) Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 99% Fluorochem
Purity 99% min APIChem
Melting_Point ca 200? dec. Alfa-Aesar
Melting_Point ca 200° dec. Alfa-Aesar
Hazard E: Explosive; XI: Irritant Acros Organics
H phrase H228: Flammable solid; H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation Acros Organics
H phrase H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation Acros Organics
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing Acros Organics
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P261: Avoid breathing dus Acros Organics
_Notes Peptide coupling reagent. Apollo Scientific
R phrase R2: Risk of explosion by shock, friction, fire or other sources of ignition.; R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
R phrase R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
Hazard XI: Irritant Acros Organics

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.