Pyaop reagent

C17H27F6N7OP2CAS 156311-83-0521.39 g/mol

FP−FFFFFNNNNOP+NNN
Tertiary amine

Properties

Molecular formula
C17H27F6N7OP2
Molar mass
521.39 g/mol
Exact mass
521.1657 Da
logP
5.60Crippen estimate
Polar surface area
62.5 Ų
H-bond donors / acceptors
0 / 7
Rotatable bonds
5

Identifiers

CAS number
156311-83-0
SMILES
F[P-](F)(F)(F)(F)F.c1cnc2c(c1)nnn2O[P+](N1CCCC1)(N1CCCC1)N1CCCC1
InChIKey
CBZAHNDHLWAZQC-UHFFFAOYSA-N
InChI
InChI=1S/C17H27N7OP.F6P/c1-2-11-21(10-1)26(22-12-3-4-13-22,23-14-5-6-15-23)25-24-17-16(19-20-24)8-7-9-18-17;1-7(2,3,4,5)6/h7-9H,1-6,10-15H2;/q+1;-1

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Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • Phosphorus(1+), [3-(hydroxy-κO)-3H-1,2,3-triazolo[4,5-b]pyridinato]tri-1-pyrrolidinyl-, (T-4)-, hexafluorophosphate(1-) (1:1)
  • Phosphonium, tri-1-pyrrolidinyl(3H-1,2,3-triazolo[4,5-b]pyridin-3-yloxy)-, hexafluorophosphate(1-)
  • Phosphorus(1+), (3-hydroxy-3H-1,2,3-triazolo[4,5-b]pyridinato-O)tri-1-pyrrolidinyl-, (T-4)-, hexafluorophosphate(1-)
  • 3H-1,2,3-Triazolo[4,5-b]pyridine, phosphonium deriv.
  • PyAOP
  • [(7-Azabenzotriazol-1-yl)oxy]tris(pyrrolidino)phosphonium hexafluorophosphate

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

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