CAS RN: 914106-26-6
4-CHLORO-3-IODOBENZONITRILE
Product Availability
Choose a grade to view its available package options.
7 package records7 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250828 | 100g | In stock | Shanghai | Inquiry |
| Batchno.20250116 | 10g | In stock | Shanghai, Tianjin, Chengdu | Inquiry |
| Batchno.20260507 | 1g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250605 | 250mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260323 | 25g | In stock | Shanghai, Chengdu | Inquiry |
| Batchno.20250226 | 500g | In stock | Shanghai | Inquiry |
| Batchno.20251103 | 5g | In stock | Shanghai, Wuhan, Chengdu | Inquiry |
- Product code: SSC-204453
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: 5g
- 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 |
|---|---|---|---|---|
| 5g | ＞97% | 0 Out of Stock | Hong Kong | Inquiry |
914106-26-6 / 4-chloro-3-iodobenzonitrile
Basic Information
CAS
914106-26-6
Multi CAS
No
Molecular Formula
C8H3LiN
Molecular Weight
263.460000
Exact Mass
262.899870
InChI
InChI=1S/C7H3ClIN/c8-6-2-1-5(4-10)3-7(6)9/h1-3H
InChIKey
WUNSVSXKDMQXSB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
H-bond acceptors
1
Molar refractivity
48.88
TPSA
23.79
LogP / Solubility
WLOGP
2.82
MLOGP
2.49
XLogP3
3.3
Consensus LogP
2.87
Log S (ESOL)
-3.69
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.75
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.71
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.33
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
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