CAS RN: 4519-28-2

TETRAMETHYLPHOSPHONIUM BROMIDE

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7 package records6 with current stock3 grade groups
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Batchno.20250908 1g In stock Inquiry
Batchno.20250710 200mg Out of stock Inquiry
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  • Product code: starshine_CAS4519-28-2
  • Purity/Analytical Methods: >99.0%
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4519-28-2 / tetramethylphosphanium bromide

Standard CAS: 4519-28-2 Multi CAS: No

Basic Information

CAS
4519-28-2
Multi CAS
No
Molecular Formula
C4H12BRP
Molecular Weight
171.020000
Exact Mass
169.986000
InChI
InChI=1S/C4H12P.BrH/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1
InChIKey
ZTXFOCMYRCGSMU-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
H-bond acceptors
1
Molar refractivity
30.62
TPSA
0.0000

LogP / Solubility

WLOGP
-1.47
MLOGP
-1.3
XLogP3
-1.47
Consensus LogP
-1.41
Log S (ESOL)
0.03
Class (ESOL)
Highly soluble
Log S (Ali)
0.1
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.45
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.81

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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