CAS RN: 16921-91-8

NITROSONIUM HEXAFLUOROPHOSPHATE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250108 250mg / 1g / 5g Confirm by inquiry Shanghai, Chongqing, Hebei Inquiry
  • Product code: starshine_CAS16921-91-8
  • Purity/Analytical Methods: >99.0%
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16921-91-8 / azanylidyneoxidanium hexafluorophosphate

Standard CAS: 16921-91-8 Multi CAS: No

Basic Information

CAS
16921-91-8
Multi CAS
No
Molecular Formula
F6NOP
Molecular Weight
174.970000
Exact Mass
174.962170
SMILES
N#[O+].F[P-](F)(F)(F)(F)F
InChI
InChI=1S/F6P.NO/c1-7(2,3,4,5)6;1-2/q-1;+1
InChIKey
SAKPNYRUBHJGAR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
H-bond acceptors
1
Molar refractivity
15.98
TPSA
43.69

LogP / Solubility

WLOGP
3.28
MLOGP
2.88
XLogP3
3.28
Consensus LogP
3.15
Log S (ESOL)
-2.99
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.36
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.52
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.46

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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