O-(7-Azabenzotriazol-1-yl)-N,N,N′,N′-tetramethyluronium hexafluorophosphate

CAS Registry Number®

148893-10-1
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CAS Name

O-(7-Azabenzotriazol-1-yl)-N,N,N′,N′-tetramethyluronium hexafluorophosphate

Molecular Formula

C10H15N6O.F6P

Cite this Page

O-(7-Azabenzotriazol-1-yl)-N,N,N′,N′-tetramethyluronium hexafluorophosphate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=148893-10-1 (retrieved 2024-03-28) (CAS RN: 148893-10-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H15N6O.F6P/c1-13(2)10(14(3)4)15-8-6-5-7-11-9(8)16(17)12-15;1-7(2,3,4,5)6/h5-7H,1-4H3;/q+1;-1

InChIKey

InChIKey=FKBFHOSFPRWJNV-UHFFFAOYSA-N

SMILES

C(N(C)C)(N(C)C)=[N+]1C=2C(N(=O)=N1)=NC=CC2.[P+5]([F-])([F-])([F-])([F-])([F-])[F-]

Canonical SMILES

O=N1=N[N+](C=2C=CC=NC21)=C(N(C)C)N(C)C.[F-][P+5]([F-])([F-])([F-])([F-])[F-]

Other Names for this Substance

  • 1H-1,2,3-Triazolo[4,5-b]pyridinium, 1-[bis(dimethylamino)methylene]-, 3-oxide, hexafluorophosphate(1-) (1:1)
  • 1H-1,2,3-Triazolo[4,5-b]pyridinium, 1-[bis(dimethylamino)methylene]-, hexafluorophosphate(1-), 3-oxide
  • HATU
  • O-(7-Azabenzotriazol-1-yl)-N,N,N′,N′-tetramethyluronium hexafluorophosphate
  • 1-[Bis(dimethylamino)methylene]-1H-1,2,3-triazolo[4,5-b]pyridinium 3-oxide hexafluorophosphate

Deleted or Replaced CAS Registry Numbers

190849-61-7, 199532-36-0, 1231955-72-8, 1616484-47-9, 1709799-70-1

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