CAS RN: 55453-24-2
3-CYANOPROPYLTRIMETHOXYSILANE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250603 | 10g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS55453-24-2
- Purity/Analytical Methods: >99.0%
55453-24-2 / 4-trimethoxysilylbutanenitrile
Basic Information
CAS
55453-24-2
Multi CAS
No
Molecular Formula
C7H15NO3Si
Molecular Weight
189.280000
Exact Mass
189.082120
InChI
InChI=1S/C7H15NO3Si/c1-9-12(10-2,11-3)7-5-4-6-8/h4-5,7H2,1-3H3
InChIKey
FPJPAIQDDFIEKJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
0.86
Rotatable bonds
6
H-bond acceptors
4
Molar refractivity
46.44
TPSA
51.48
LogP / Solubility
WLOGP
1.17
MLOGP
1.03
XLogP3
1.17
Consensus LogP
1.12
Log S (ESOL)
-1.35
Class (ESOL)
Soluble
Log S (Ali)
-1.96
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.58
Class (SILICOS-IT)
Moderately 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)
-3.05
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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