CAS RN: 459424-72-7
1-Iodo-2,3,4-trifluorobenzene
Product Availability
Choose a grade to view its available package options.
9 package records8 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260510 | 100g | Out of stock | Inquiry | |
| Batchno.20251128 | 10g | In stock | Shanghai, Shenzhen, Wuhan, Chengdu | Inquiry |
| Batchno.20260510 | 1g | In stock | Shanghai, Wuhan, Chengdu | Inquiry |
| Batchno.20260527 | 25g | In stock | Shenzhen | Inquiry |
| Batchno.20250530 | 5g | In stock | Shanghai, Wuhan, Chengdu | Inquiry |
- Product code: SSC-153537
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: 25g
- 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 |
|---|---|---|---|---|
| 25g | ＞97% | 0 Out of Stock | Shenzhen | Inquiry |
459424-72-7 / 1,2,4-trifluoro-5-iodobenzene
Basic Information
CAS
459424-72-7
Multi CAS
Yes
Molecular Formula
C6F3H2I
Molecular Weight
257.980000
Exact Mass
257.915330
InChI
InChI=1S/C6H2F3I/c7-3-1-2-4(10)6(9)5(3)8/h1-2H
InChIKey
YDSUNVSIBZATIU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
H-bond acceptors
3
Molar refractivity
39.03
TPSA
0.0000
LogP / Solubility
WLOGP
2.71
MLOGP
2.39
XLogP3
2.9
Consensus LogP
2.67
Log S (ESOL)
-3.59
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.63
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.58
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.37
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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