Phosphorus(1+), [3-(hydroxy-κO)-3H-1,2,3-triazolo[4,5-b]pyridinato]tri-1-pyrrolidinyl-, (T-4)-, hexafluorophosphate(1-) (1:1)
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Phosphorus(1+), [3-(hydroxy-κO)-3H-1,2,3-triazolo[4,5-b]pyridinato]tri-1-pyrrolidinyl-, (T-4)-, hexafluorophosphate(1-) (1:1)
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CAS No:
156311-83-0
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Formula:
C17H27N7OP.F6P
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Chemical Name:
Phosphorus(1+), [3-(hydroxy-κO)-3H-1,2,3-triazolo[4,5-b]pyridinato]tri-1-pyrrolidinyl-, (T-4)-, hexafluorophosphate(1-) (1:1)
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Synonyms:
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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CAS No:
Description
(3-Hydroxy-3H-1,2,3-triazolo[4,5-b]pyridinato-O)tri-1-pyrrolidinylphosphonium hexafluorophosphate is white to off-white crystalline powder
Phosphorus(1+), [3-(hydroxy-κO)-3H-1,2,3-triazolo[4,5-b]pyridinato]tri-1-pyrrolidinyl-, (T-4)-, hexafluorophosphate(1-) (1:1) Basic Attributes
521.38
521.16600
1533716-785-6
29339900
Characteristics
62.6
5.41600
White to off-white Powder or Crystalline Powder
163-168 °C(lit.)
Soluble in water.
-20°C
Safety Information
NONH for all modes of transport
3
36/37/38
26-36
TH3890000
Xi
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 157 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Phosphorus(1+), [3-(hydroxy-κO)-3H-1,2,3-triazolo[4,5-b]pyridinato]tri-1-pyrrolidinyl-, (T-4)-, hexafluorophosphate(1-) (1:1) Use and Manufacturing
Used as a coupling reagent in solid phase peptide synthesis.It is preferred over HATU, because it does not side react at the N-terminus of the peptide.Compared to the HOBt derivates, PyAOP (and HOAt in general) are more reactive due to the additional nitrogen.
Computed Properties
Molecular Weight:521.4
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:5
Exact Mass:521.16565148
Monoisotopic Mass:521.16565148
Topological Polar Surface Area:62.6
Heavy Atom Count:33
Complexity:502
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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Phosphorus(1+), [3-(hydroxy-κO)-3H-1,2,3-triazolo[4,5-b]pyridinato]tri-1-pyrrolidinyl-, (T-4)-, hexafluorophosphate(1-) (1:1)
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