CAS RN: 694-53-1
Phenylsilane
Product Availability
Choose a grade to view its available package options.
6 package records1 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250823 | 1ml / 5ml / 25ml / 100ml / 500ml | Confirm by inquiry | Shanghai, Shandong, Chongqing, Hebei | Inquiry |
- Product code: ICTP1291
- Purity/Analytical Methods: >96.0%(GC)
694-53-1 / phenylsilane
Basic Information
CAS
694-53-1
Multi CAS
Yes
Molecular Formula
C6H8Si
Molecular Weight
108.210000
Exact Mass
108.039527
InChI
InChI=1S/C6H8Si/c7-6-4-2-1-3-5-6/h1-5H,7H3
InChIKey
PARWUHTVGZSQPD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Aromatic heavy atom count
6
Molar refractivity
36.02
TPSA
0.0000
LogP / Solubility
WLOGP
-0.32
MLOGP
-0.29
XLogP3
-0.32
Consensus LogP
-0.31
Log S (ESOL)
-0.94
Class (ESOL)
Very soluble
Log S (Ali)
-0.21
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.1
Class (SILICOS-IT)
Very 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)
-3.61
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
