![CAS 75867-39-9 4-[(Trimethylsilyl)ethynyl]aniline molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/t3702-jpgcontextbwfzdgvyfhjvb3r8mjgzmth8aw1hz2uvanblz3xoymuvage1lzg5mzi3mjaznzc4odyvvdm3mdiuanbnfdnkntc5yjljmgm4mzyznzqxnze2owmzote3zjnly2nknjm0mmu4ndhjyte1ogfhmjzmn2y0mjfmyzi3ywnkmmm.jpeg)
CAS RN: 75867-39-9
4-[(Trimethylsilyl)ethynyl]aniline
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250102 | 50mg / 250mg / 1g / 5g | Confirm by inquiry | Hebei, Shanghai | Inquiry |
- Product code: SSC-185294
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥97% | 0 Out of Stock | Shanghai | Inquiry |
75867-39-9 / 4-(2-trimethylsilylethynyl)aniline
Basic Information
CAS
75867-39-9
Multi CAS
No
Molecular Formula
C11H15NSi
Molecular Weight
189.330000
Exact Mass
189.097376
InChI
InChI=1S/C11H15NSi/c1-13(2,3)9-8-10-4-6-11(12)7-5-10/h4-7H,12H2,1-3H3
InChIKey
CHTZIDLXGXGNMA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.27
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
61.08
TPSA
26.02
LogP / Solubility
WLOGP
2.5
MLOGP
2.2
XLogP3
2.5
Consensus LogP
2.4
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.92
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.96
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)
-2.1
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
