O-(Benzotriazol-1-yl)-N,N,N′,N′-tetramethyluronium tetrafluoroborate
Properties
- Molecular formula
- C11H16BF4N5O
- Molar mass
- 321.09 g/mol
- Exact mass
- 321.1384 Da
- logP
- 1.01Crippen estimate
- Polar surface area
- 51.0 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 0
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
125700-67-6SMILES
CN(C)C(n1n[n+]([O-])c2ccccc21)=[N+](C)C.F[B-](F)(F)FInChIKey
ZXZJCMUCQIOBGO-UHFFFAOYSA-NInChI
InChI=1S/C11H16N5O.BF4/c1-13(2)11(14(3)4)15-9-7-5-6-8-10(9)16(17)12-15;2-1(3,4)5/h5-8H,1-4H3;/q+1;-1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 1H-Benzotriazolium, 1-[bis(dimethylamino)methylene]-, 3-oxide, tetrafluoroborate(1-) (1:1)
- 1H-Benzotriazolium, 1-[bis(dimethylamino)methylene]-, 3-oxide, tetrafluoroborate(1-)
- TBTU
- O-Benzotriazolyl tetramethylisouronium tetrafluoroborate
- (Benzotriazol-1-yloxy-dimethylamino-methylene)dimethylammonium tetrafluoroborate
- 2-(1H-Benzotriazol-1-yl)-N,N,N′,N′-tetramethylammonium tetrafluoroborate
- O-Benzotriazol-1-yl-tetramethyluronium tetrafluoroborate
Work with O-(Benzotriazol-1-yl)-N,N,N′,N′-tetramethyluronium tetrafluoroborate
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
TCTU330641-16-272 % similar
HCTU330645-87-957 % similar
HATU148893-10-156 % similar
N,N,N',N'-Tetramethyl-S-(1-oxido-2-pyridyl)thiouronium Tetrafluoroborate255825-38-841 % similar
2-(2-Pyridon-1-yl)-1,1,3,3-tetramethyluronium tetrafluoroborate125700-71-236 % similar
2-(7-Azabenzotriazole-1-yl)-1,1,3,3-tetramethyluronium tetrafluoroborate873798-09-535 % similar
N,N,N',N'-Tetramethyl-O-(3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl)uronium tetrafluoroborate125700-69-834 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.