PyBOP

CAS Registry Number®

128625-52-5

CAS Name

PyBOP

Molecular Formula

C18H28N6OP.F6P

Cite this Page

PyBOP.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=128625-52-5 (retrieved 2024-11-23) (CAS RN: 128625-52-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    156-157 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C18H28N6OP.F6P/c1-2-10-18-17(9-1)19-20-24(18)25-26(21-11-3-4-12-21,22-13-5-6-14-22)23-15-7-8-16-23;1-7(2,3,4,5)6/h1-2,9-10H,3-8,11-16H2;/q+1;-1

InChIKey

InChIKey=VIAFLMPQBHAMLI-UHFFFAOYSA-N

SMILES

[P+](ON1C=2C(N=N1)=CC=CC2)(N3CCCC3)(N4CCCC4)N5CCCC5.[P+5]([F-])([F-])([F-])([F-])([F-])[F-]

Canonical SMILES

[F-][P+5]([F-])([F-])([F-])([F-])[F-].N1=NN(O[P+](N2CCCC2)(N3CCCC3)N4CCCC4)C=5C=CC=CC15

Other Names for this Substance

  • Phosphorus(1+), [1-(hydroxy-κO)-1H-benzotriazolato]tri-1-pyrrolidinyl-, (T-4)-, hexafluorophosphate(1-) (1:1)
  • Pyrrolidine, phosphorus complex
  • 1H-Benzotriazole, 1-hydroxy-, phosphorus complex
  • PyBOP
  • Benzotriazol-1-yloxytripyrrolidinophosphonium hexafluorophosphate

View All

Deleted or Replaced CAS Registry Numbers

1006589-06-5

CAS INSIGHTSTM
Hourglass and a clock