[email protected]
CAS 561069-04-3 P-TRIFLUOROMETHYLTETRAFLUOROPHENYLTRIETHOXYSILANE molecular structure lightbox
CAS RN: 561069-04-3

P-TRIFLUOROMETHYLTETRAFLUOROPHENYLTRIETHOXYSILANE

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250506 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS561069-04-3
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

561069-04-3 / triethoxy-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]silane

Standard CAS: 561069-04-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
561069-04-3
Multi CAS
No
Molecular Formula
C13F7H15O3Si
Molecular Weight
380.330000
Exact Mass
380.067868
InChI
InChI=1S/C13H15F7O3Si/c1-4-21-24(22-5-2,23-6-3)12-10(16)8(14)7(13(18,19)20)9(15)11(12)17/h4-6H2,1-3H3
InChIKey
FNHRVMWUGNXEKZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
6
Fraction Csp3
0.54
Rotatable bonds
7
H-bond acceptors
3
Molar refractivity
71.54
TPSA
27.69

LogP / Solubility

WLOGP
3.52
MLOGP
3.12
XLogP3
3.52
Consensus LogP
3.39
Log S (ESOL)
-4.14
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.22
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.89
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.54

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

Customers Also Viewed

Get In Touch

Contact Us