CAS RN: 82112-22-9

4,8-Dioxa-3,9-disilaundecane, 2,2,3,3,9,9,10,10-octamethyl-

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250817 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS82112-22-9
  • Purity/Analytical Methods: >99.0%
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82112-22-9 / tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxypropoxy]-dimethylsilane

Standard CAS: 82112-22-9 Multi CAS: No

Basic Information

CAS
82112-22-9
Multi CAS
No
Molecular Formula
C15H36O2Si2
Molecular Weight
304.610000
Exact Mass
304.225383
InChI
InChI=1S/C15H36O2Si2/c1-14(2,3)18(7,8)16-12-11-13-17-19(9,10)15(4,5)6/h11-13H2,1-10H3
InChIKey
NZXKZNIFNMOTHZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
1
Rotatable bonds
6
H-bond acceptors
2
Molar refractivity
90.92
TPSA
18.46

LogP / Solubility

WLOGP
5.42
MLOGP
4.78
XLogP3
5.42
Consensus LogP
5.21
Log S (ESOL)
-4.75
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.97
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.86
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.73

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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